data_18461 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Chemical shift assignments and backbone dynamics of H-Ras-GppNHp bound to Ras-binding domain of cRaf1. ; _BMRB_accession_number 18461 _BMRB_flat_file_name bmr18461.str _Entry_type original _Submission_date 2012-05-15 _Accession_date 2012-05-15 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Araki Mitsugu . . 2 Tamura Atsuo . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 T1_relaxation 1 T2_relaxation 1 heteronucl_NOE 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 162 "13C chemical shifts" 163 "15N chemical shifts" 162 "T1 relaxation values" 134 "T2 relaxation values" 135 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-06-26 original author . stop_ loop_ _Related_BMRB_accession_number _Relationship 17610 'GppNHp-bound H-RasT35S mutant protein' stop_ _Original_release_date 2012-06-26 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution structure of the state 1 conformer of GTP-bound H-Ras protein and distinct dynamic properties between the state 1 and state 2 conformers' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 21930707 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Araki Mitsugu . . 2 Shima Fumi . . 3 Yoshikawa Yoko . . 4 Muraoka Shin . . 5 Ijiri Yuichi . . 6 Nagahara Yuka . . 7 Shirono Tomoya . . 8 Kataoka Tohru . . 9 Tamura Atsuo . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume 286 _Journal_issue 45 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 39644 _Page_last 39653 _Year 2011 _Details . loop_ _Keyword Ras 'Signaling protein' 'GTP-bound form' 'Conformational states' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name H-Ras-GppNHp _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label H-Ras-GppNHp $entity_1 'PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER' $entity_GNP 'MAGNESIUM ION' $entity_MG water $entity_HOH 'Ras-binding domain of cRaf1' $entry_2 stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1 _Molecular_mass 18861.303 _Mol_thiol_state 'all free' _Details 'The N-terminal sequence GPLGSD is identified as EXPRESSION TAG' ############################## # Polymer residue sequence # ############################## _Residue_count 172 _Mol_residue_sequence ; GPLGSDMTEYKLVVVGAGGV GKSALTIQLIQNHFVDEYDP TIEDSYRKQVVIDGETCLLD ILDTAGQEEYSAMRDQYMRT GEGFLCVFAINNTKSFEDIH QYREQIKRVKDSDDVPMVLV GNKCDLAARTVESRQAQDLA RSYGIPYIETSAKTRQGVED AFYTLVREIRQH ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -5 GLY 2 -4 PRO 3 -3 LEU 4 -2 GLY 5 -1 SER 6 0 ASP 7 1 MET 8 2 THR 9 3 GLU 10 4 TYR 11 5 LYS 12 6 LEU 13 7 VAL 14 8 VAL 15 9 VAL 16 10 GLY 17 11 ALA 18 12 GLY 19 13 GLY 20 14 VAL 21 15 GLY 22 16 LYS 23 17 SER 24 18 ALA 25 19 LEU 26 20 THR 27 21 ILE 28 22 GLN 29 23 LEU 30 24 ILE 31 25 GLN 32 26 ASN 33 27 HIS 34 28 PHE 35 29 VAL 36 30 ASP 37 31 GLU 38 32 TYR 39 33 ASP 40 34 PRO 41 35 THR 42 36 ILE 43 37 GLU 44 38 ASP 45 39 SER 46 40 TYR 47 41 ARG 48 42 LYS 49 43 GLN 50 44 VAL 51 45 VAL 52 46 ILE 53 47 ASP 54 48 GLY 55 49 GLU 56 50 THR 57 51 CYS 58 52 LEU 59 53 LEU 60 54 ASP 61 55 ILE 62 56 LEU 63 57 ASP 64 58 THR 65 59 ALA 66 60 GLY 67 61 GLN 68 62 GLU 69 63 GLU 70 64 TYR 71 65 SER 72 66 ALA 73 67 MET 74 68 ARG 75 69 ASP 76 70 GLN 77 71 TYR 78 72 MET 79 73 ARG 80 74 THR 81 75 GLY 82 76 GLU 83 77 GLY 84 78 PHE 85 79 LEU 86 80 CYS 87 81 VAL 88 82 PHE 89 83 ALA 90 84 ILE 91 85 ASN 92 86 ASN 93 87 THR 94 88 LYS 95 89 SER 96 90 PHE 97 91 GLU 98 92 ASP 99 93 ILE 100 94 HIS 101 95 GLN 102 96 TYR 103 97 ARG 104 98 GLU 105 99 GLN 106 100 ILE 107 101 LYS 108 102 ARG 109 103 VAL 110 104 LYS 111 105 ASP 112 106 SER 113 107 ASP 114 108 ASP 115 109 VAL 116 110 PRO 117 111 MET 118 112 VAL 119 113 LEU 120 114 VAL 121 115 GLY 122 116 ASN 123 117 LYS 124 118 CYS 125 119 ASP 126 120 LEU 127 121 ALA 128 122 ALA 129 123 ARG 130 124 THR 131 125 VAL 132 126 GLU 133 127 SER 134 128 ARG 135 129 GLN 136 130 ALA 137 131 GLN 138 132 ASP 139 133 LEU 140 134 ALA 141 135 ARG 142 136 SER 143 137 TYR 144 138 GLY 145 139 ILE 146 140 PRO 147 141 TYR 148 142 ILE 149 143 GLU 150 144 THR 151 145 SER 152 146 ALA 153 147 LYS 154 148 THR 155 149 ARG 156 150 GLN 157 151 GLY 158 152 VAL 159 153 GLU 160 154 ASP 161 155 ALA 162 156 PHE 163 157 TYR 164 158 THR 165 159 LEU 166 160 VAL 167 161 ARG 168 162 GLU 169 163 ILE 170 164 ARG 171 165 GLN 172 166 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-25 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 10051 RasY32W 97.67 178 98.81 99.40 1.06e-117 BMRB 17183 Ras 96.51 166 100.00 100.00 1.95e-117 BMRB 17610 "GppNHp-bound H-RasT35S mutant protein" 100.00 172 99.42 100.00 5.38e-122 BMRB 17678 HRas166 96.51 166 100.00 100.00 1.95e-117 BMRB 18479 HRas166 96.51 166 100.00 100.00 1.95e-117 BMRB 18629 entity_1 96.51 166 99.40 100.00 6.69e-117 BMRB 25730 H-Ras_G12V 98.26 169 98.82 98.82 1.42e-117 PDB 121P "Struktur Und Guanosintriphosphat-Hydrolysemechanismus Des C- Terminal Verkuerzten Menschlichen Krebsproteins P21-H-Ras" 96.51 166 100.00 100.00 1.95e-117 PDB 1AA9 "Human C-Ha-Ras(1-171)(Dot)gdp, Nmr, Minimized Average Structure" 96.51 171 100.00 100.00 1.76e-117 PDB 1AGP "Three-Dimensional Structures And Properties Of A Transforming And A Nontransforming Gly-12 Mutant Of P21-H-Ras" 96.51 166 99.40 99.40 1.85e-116 PDB 1BKD "Complex Of Human H-Ras With Human Sos-1" 96.51 166 100.00 100.00 1.95e-117 PDB 1CLU "H-Ras Complexed With Diaminobenzophenone-Beta,Gamma-Imido- Gtp" 96.51 166 99.40 99.40 3.27e-116 PDB 1CRP "The Solution Structure And Dynamics Of Ras P21. Gdp Determined By Heteronuclear Three And Four Dimensional Nmr Spectroscopy" 96.51 166 100.00 100.00 1.95e-117 PDB 1CRQ "The Solution Structure And Dynamics Of Ras P21. Gdp Determined By Heteronuclear Three And Four Dimensional Nmr Spectroscopy" 96.51 166 100.00 100.00 1.95e-117 PDB 1CRR "The Solution Structure And Dynamics Of Ras P21. Gdp Determined By Heteronuclear Three And Four Dimensional Nmr Spectroscopy" 96.51 166 100.00 100.00 1.95e-117 PDB 1CTQ "Structure Of P21ras In Complex With Gppnhp At 100 K" 96.51 166 100.00 100.00 1.95e-117 PDB 1GNP "X-Ray Crystal Structure Analysis Of The Catalytic Domain Of The Oncogene Product P21h-Ras Complexed With Caged Gtp And Mant Dgp" 96.51 166 100.00 100.00 1.95e-117 PDB 1GNQ "X-Ray Crystal Structure Analysis Of The Catalytic Domain Of The Oncogene Product P21h-Ras Complexed With Caged Gtp And Mant Dgp" 96.51 166 100.00 100.00 1.95e-117 PDB 1GNR "X-Ray Crystal Structure Analysis Of The Catalytic Domain Of The Oncogene Product P21h-Ras Complexed With Caged Gtp And Mant Dgp" 96.51 166 100.00 100.00 1.95e-117 PDB 1HE8 "Ras G12v-Pi 3-Kinase Gamma Complex" 96.51 166 99.40 99.40 2.38e-116 PDB 1IAQ "C-H-Ras P21 Protein Mutant With Thr 35 Replaced By Ser (T35s) Complexed With Guanosine-5'-[b,G-Imido] Triphosphate" 96.51 166 99.40 100.00 6.69e-117 PDB 1IOZ "Crystal Structure Of The C-Ha-Ras Protein Prepared By The Cell-Free Synthesis" 96.51 171 100.00 100.00 1.76e-117 PDB 1JAH "H-Ras P21 Protein Mutant G12p, Complexed With Guanosine-5'- [beta,Gamma-Methylene] Triphosphate And Magnesium" 96.51 166 98.80 98.80 2.34e-115 PDB 1JAI "H-Ras P21 Protein Mutant G12p, Complexed With Guanosine-5'- [beta,Gamma-Methylene] Triphosphate And Manganese" 96.51 166 99.40 99.40 3.27e-116 PDB 1K8R "Crystal Structure Of Ras-Bry2rbd Complex" 96.51 166 100.00 100.00 1.95e-117 PDB 1LF0 "Crystal Structure Of Rasa59g In The Gtp-Bound Form" 96.51 166 99.40 99.40 1.35e-116 PDB 1LF5 "Crystal Structure Of Rasa59g In The Gdp-Bound Form" 96.51 166 99.40 99.40 1.35e-116 PDB 1LFD "Crystal Structure Of The Active Ras Protein Complexed With The Ras-interacting Domain Of Ralgds" 96.51 167 99.40 100.00 6.28e-117 PDB 1NVU "Structural Evidence For Feedback Activation By Rasgtp Of The Ras-Specific Nucleotide Exchange Factor Sos" 96.51 166 99.40 99.40 1.35e-116 PDB 1NVV "Structural Evidence For Feedback Activation By Rasgtp Of The Ras-specific Nucleotide Exchange Factor Sos" 96.51 166 100.00 100.00 1.95e-117 PDB 1NVW "Structural Evidence For Feedback Activation By Rasgtp Of The Ras-specific Nucleotide Exchange Factor Sos" 96.51 166 100.00 100.00 1.95e-117 PDB 1NVX "Structural Evidence For Feedback Activation By Rasgtp Of The Ras-Specific Nucleotide Exchange Factor Sos" 96.51 166 99.40 99.40 1.35e-116 PDB 1P2S "H-Ras 166 In 50% 2,2,2 Triflouroethanol" 96.51 166 100.00 100.00 1.95e-117 PDB 1P2T "H-Ras 166 In Aqueous Mother Liqour, Rt" 96.51 166 100.00 100.00 1.95e-117 PDB 1P2U "H-Ras In 50% Isopropanol" 96.51 166 100.00 100.00 1.95e-117 PDB 1P2V "H-Ras 166 In 60 % 1,6 Hexanediol" 96.51 166 100.00 100.00 1.95e-117 PDB 1PLJ "Crystallographic Studies On P21h-Ras Using Synchrotron Laue Method: Improvement Of Crystal Quality And Monitoring Of The Gtpase" 96.51 166 99.40 99.40 3.27e-116 PDB 1PLK "Crystallographic Studies On P21h-Ras Using Synchrotron Laue Method: Improvement Of Crystal Quality And Monitoring Of The Gtpase" 96.51 166 98.80 98.80 2.34e-115 PDB 1PLL "Crystallographic Studies On P21h-Ras Using Synchrotron Laue Method: Improvement Of Crystal Quality And Monitoring Of The Gtpase" 96.51 166 99.40 99.40 3.27e-116 PDB 1Q21 "Crystal Structures At 2.2 Angstroms Resolution Of The Catalytic Domains Of Normal Ras Protein And An Oncogenic Mutant Complexed" 96.51 171 100.00 100.00 1.76e-117 PDB 1QRA "Structure Of P21ras In Complex With Gtp At 100 K" 96.51 166 100.00 100.00 1.95e-117 PDB 1RVD "H-Ras Complexed With Diaminobenzophenone-Beta,Gamma-Imido- Gtp" 96.51 166 99.40 99.40 2.38e-116 PDB 1WQ1 "Ras-Rasgap Complex" 96.51 166 100.00 100.00 1.95e-117 PDB 1XCM "Crystal Structure Of The Gppnhp-Bound H-Ras G60a Mutant" 96.51 167 98.80 98.80 2.42e-115 PDB 1XD2 "Crystal Structure Of A Ternary Ras:sos:ras*gdp Complex" 96.51 166 100.00 100.00 1.95e-117 PDB 1XJ0 "Crystal Structure Of The Gdp-Bound Form Of The Rasg60a Mutant" 96.51 166 98.80 98.80 2.14e-115 PDB 1ZVQ "Structure Of The Q61g Mutant Of Ras In The Gdp-Bound Form" 96.51 166 99.40 99.40 3.85e-116 PDB 1ZW6 "Crystal Structure Of The Gtp-Bound Form Of Rasq61g" 96.51 166 98.80 98.80 8.96e-115 PDB 221P "Three-Dimensional Structures Of H-Ras P21 Mutants: Molecular Basis For Their Inability To Function As Signal Switch Molecules" 96.51 166 99.40 100.00 8.06e-117 PDB 2C5L "Structure Of Plc Epsilon Ras Association Domain With Hras" 100.00 173 97.09 97.09 6.20e-117 PDB 2CE2 "Crystal Structure Analysis Of A Fluorescent Form Of H-ras P21 In Complex With Gdp" 96.51 166 98.80 98.80 1.18e-114 PDB 2CL0 "Crystal Structure Analysis Of A Fluorescent Form Of H-Ras P21 In Complex With Gppnhp" 96.51 166 98.80 98.80 1.18e-114 PDB 2CL6 "Crystal Structure Analysis Of A Fluorescent Form Of H-ras P21 In Complex With S-caged Gtp" 96.51 166 98.80 98.80 1.18e-114 PDB 2CL7 "Crystal Structure Analysis Of A Fluorescent Form Of H-ras P21 In Complex With Gtp" 96.51 166 98.80 98.80 1.18e-114 PDB 2CLC "Crystal Structure Analysis Of A Fluorescent Form Of H-ras P21 In Complex With Gtp (2)" 96.51 166 98.80 98.80 1.18e-114 PDB 2CLD "Crystal Structure Analysis Of A Fluorescent Form Of H-ras P21 In Complex With Gdp (2)" 96.51 166 99.40 99.40 2.13e-116 PDB 2EVW "Crystal Structure Analysis Of A Fluorescent Form Of H-Ras P21 In Complex With R-Caged Gtp" 96.51 166 98.80 98.80 1.18e-114 PDB 2LCF "Solution Structure Of Gppnhp-Bound H-Rast35s Mutant Protein" 100.00 172 99.42 100.00 5.38e-122 PDB 2LWI "Solution Structure Of H-rast35s Mutant Protein In Complex With Kobe2601" 100.00 172 99.42 100.00 5.38e-122 PDB 2N42 "Ec-nmr Structure Of Human H-rast35s Mutant Protein Determined By Combining Evolutionary Couplings (ec) And Sparse Nmr Data" 100.00 172 99.42 100.00 5.38e-122 PDB 2N46 "Ec-nmr Structure Of Human H-rast35s Mutant Protein Determined By Combining Evolutionary Couplings (ec) And Sparse Nmr Data" 100.00 172 99.42 100.00 5.38e-122 PDB 2Q21 "Crystal Structures At 2.2 Angstroms Resolution Of The Catalytic Domains Of Normal Ras Protein And An Oncogenic Mutant Complexed" 96.51 171 99.40 99.40 1.89e-116 PDB 2QUZ "Crystal Structure Of The Activating H-Rask117r Mutant In Costello Syndrome, Bound To Mg-Gdp" 96.51 166 99.40 100.00 5.56e-117 PDB 2RGA "Crystal Structure Of H-Rasq61i-Gppnhp" 96.51 166 99.40 99.40 2.74e-116 PDB 2RGB "Crystal Structure Of H-Rasq61k-Gppnhp" 96.51 166 99.40 100.00 5.21e-117 PDB 2RGC "Crystal Structure Of H-Rasq61v-Gppnhp" 96.51 166 99.40 99.40 2.46e-116 PDB 2RGD "Crystal Structure Of H-Rasq61l-Gppnhp" 96.51 166 99.40 99.40 1.73e-116 PDB 2RGE "Crystal Structure Of H-Ras-Gppnhp" 96.51 166 100.00 100.00 1.95e-117 PDB 2RGG "Crystal Structure Of H-Rasq61i-Gppnhp, Trigonal Crystal Form" 96.51 166 99.40 99.40 2.74e-116 PDB 2UZI "Crystal Structure Of Hras(G12v) - Anti-Ras Fv Complex" 96.51 166 99.40 99.40 2.38e-116 PDB 2VH5 "Crystal Structure Of Hras(G12v) - Anti-Ras Fv (Disulfide Free Mutant) Complex" 96.51 166 99.40 99.40 2.38e-116 PDB 2X1V "Crystal Structure Of The Activating H-Ras I163f Mutant In Costello Syndrome, Bound To Mg-Gdp" 96.51 166 99.40 99.40 1.03e-116 PDB 3DDC "Crystal Structure Of Nore1a In Complex With Ras" 96.51 166 98.80 100.00 2.30e-116 PDB 3I3S "Crystal Structure Of H-Ras With Thr50 Replaced By Isoleucine" 96.51 166 99.40 99.40 1.50e-116 PDB 3K8Y "Allosteric Modulation Of H-Ras Gtpase" 96.51 166 100.00 100.00 1.95e-117 PDB 3K9L "Allosteric Modulation Of H-Ras Gtpase" 96.51 166 99.40 100.00 4.23e-117 PDB 3K9N "Allosteric Modulation Of H-Ras Gtpase" 96.51 166 99.40 100.00 4.23e-117 PDB 3KKM "Crystal Structure Of H-ras T35s In Complex With Gppnhp" 100.00 172 99.42 100.00 5.38e-122 PDB 3KKN "Crystal Structure Of H-ras T35s In Complex With Gppnhp" 100.00 172 99.42 100.00 5.38e-122 PDB 3KUD "Complex Of Ras-Gdp With Rafrbd(A85k)" 96.51 166 100.00 100.00 1.95e-117 PDB 3L8Y "Complex Of Ras With Cyclen" 96.51 166 100.00 100.00 1.95e-117 PDB 3L8Z "H-Ras Wildtype New Crystal Form" 96.51 166 100.00 100.00 1.95e-117 PDB 3LBH "Ras Soaked In Calcium Acetate" 96.51 166 100.00 100.00 1.95e-117 PDB 3LBI "Ras Soaked In Magnesium Acetate And Back Soaked In Calcium A" 96.51 166 100.00 100.00 1.95e-117 PDB 3LBN "Ras Soaked In Magnesium Acetate" 96.51 166 100.00 100.00 1.95e-117 PDB 3LO5 "Crystal Structure Of The Dominant Negative S17n Mutant Of Ras" 96.51 166 99.40 100.00 6.13e-117 PDB 3OIU 'H-Rasq61l With Allosteric Switch In The "on" State' 96.51 166 99.40 99.40 1.73e-116 PDB 3OIV 'H-Rasg12v With Allosteric Switch In The "off" State' 96.51 166 99.40 99.40 2.38e-116 PDB 3OIW 'H-Rasg12v With Allosteric Switch In The "on" State' 96.51 166 99.40 99.40 2.38e-116 PDB 3RRY "H-Ras Crosslinked Control, Soaked In Aqueous Solution: One Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RRZ "H-Ras In 70% Glycerol: One Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RS0 "H-Ras Soaked In Neat Cyclopentanol: One Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RS2 "H-Ras Soaked In 50% 2,2,2-Trifluoroethanol: One Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RS3 "H-Ras Soaked In Neat Hexane: 1 Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RS4 "H-Ras Soaked In 60% 1,6-Hexanediol: 1 Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RS5 "H-Ras Soaked In 55% Dimethylformamide: 1 Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RS7 "H-Ras Soaked In 50% Isopropanol: 1 Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RSL "H-Ras Soaked In 90% R,S,R-Bisfuranol: One Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3RSO "H-Ras Soaked In 20% S,R,S-Bisfuranol: 1 Of 10 In Mscs Set" 96.51 166 100.00 100.00 1.95e-117 PDB 3TGP "Room Temperature H-Ras" 96.51 166 100.00 100.00 1.95e-117 PDB 3V4F "H-Ras Peg 400CACL2, ORDERED OFF" 96.51 166 99.40 100.00 7.15e-117 PDB 421P "Three-Dimensional Structures Of H-Ras P21 Mutants: Molecular Basis For Their Inability To Function As Signal Switch Molecules" 96.51 166 99.40 99.40 2.40e-116 PDB 4DLR "H-Ras Peg 400CA(OAC)2, ORDERED OFF" 96.51 166 99.40 100.00 7.15e-117 PDB 4DLS "H-Ras Set 1 Cacl2 'mixed'" 96.51 166 100.00 100.00 1.95e-117 PDB 4DLT "H-Ras Set 2 Ca(Oac)2, On" 96.51 166 100.00 100.00 1.95e-117 PDB 4DLU "H-Ras Set 1 Ca(Oac)2, On" 96.51 166 100.00 100.00 1.95e-117 PDB 4DLV "H-Ras Set 2 Cacl2DTT, ORDERED OFF" 96.51 166 99.40 100.00 7.15e-117 PDB 4DLW "H-Ras Set 2 Ca(Oac)2DTT, ON" 96.51 166 100.00 100.00 1.95e-117 PDB 4DLX "H-Ras Set 1 Cacl2DTE, ORDERED OFF" 96.51 166 99.40 100.00 7.15e-117 PDB 4DLY "Set 1 Cacl2DTT, ORDERED OFF" 96.51 166 99.40 100.00 7.15e-117 PDB 4DLZ "H-Ras Set 2 Ca(Oac)2DTE, ORDERED OFF" 96.51 166 99.40 100.00 7.15e-117 PDB 4EFL "Crystal Structure Of H-ras Wt In Complex With Gppnhp (state 1)" 100.00 171 99.42 99.42 8.39e-120 PDB 4EFM "Crystal Structure Of H-ras G12v In Complex With Gppnhp (state 1)" 100.00 171 98.84 98.84 1.28e-118 PDB 4EFN "Crystal Structure Of H-ras Q61l In Complex With Gppnhp (state 1)" 100.00 171 98.84 98.84 8.80e-119 PDB 4G0N "Crystal Structure Of Wt H-ras-gppnhp Bound To The Rbd Of Raf Kinase" 96.51 166 100.00 100.00 1.95e-117 PDB 4G3X "Crystal Structure Of Q61l H-ras-gppnhp Bound To The Rbd Of Raf Kinase" 96.51 166 99.40 99.40 1.73e-116 PDB 4K81 "Crystal Structure Of The Grb14 Ra And Ph Domains In Complex With Gtp- Loaded H-ras" 100.00 171 97.67 98.26 3.43e-117 PDB 4L9S "Crystal Structure Of H-ras G12c, Gdp-bound" 100.00 171 97.67 98.26 4.04e-117 PDB 4L9W "Crystal Structure Of H-ras G12c, Gmppnp-bound" 100.00 171 97.67 98.26 4.04e-117 PDB 4NYI "Approach For Targeting Ras With Small Molecules That Activate Sos- Mediated Nucleotide Exchange" 96.51 167 100.00 100.00 2.10e-117 PDB 4NYJ "Approach For Targeting Ras With Small Molecules That Activate Sos- Mediated Nucleotide Exchange" 96.51 166 100.00 100.00 1.95e-117 PDB 4NYM "Approach For Targeting Ras With Small Molecules That Activate Sos- Mediated Nucleotide Exchange" 96.51 166 100.00 100.00 1.95e-117 PDB 4Q21 "Molecular Switch For Signal Transduction: Structural Differences Between Active And Inactive Forms Of Protooncogenic Ras Protei" 96.51 189 100.00 100.00 8.75e-117 PDB 4RSG "Neutron Crystal Structure Of Ras Bound To The Gtp Analogue Gppnhp" 96.51 166 100.00 100.00 1.95e-117 PDB 4URU "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4URV "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4URW "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4URX "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4URY "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4URZ "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4US0 "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4US1 "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4US2 "The Crystal Structure Of H-ras And Sos In Complex With Ligands" 98.26 185 99.41 99.41 1.46e-118 PDB 4XVQ "H-ras Y137e" 96.51 166 99.40 99.40 4.29e-116 PDB 4XVR "H-ras Y137f" 96.51 166 99.40 100.00 4.23e-117 PDB 521P "Three-Dimensional Structures Of H-Ras P21 Mutants: Molecular Basis For Their Inability To Function As Signal Switch Molecules" 96.51 166 98.80 98.80 1.25e-115 PDB 5P21 "Refined Crystal Structure Of The Triphosphate Conformation Of H-Ras P21 At 1.35 Angstroms Resolution: Implications For The Mech" 96.51 166 100.00 100.00 1.95e-117 PDB 621P "Three-Dimensional Structures Of H-Ras P21 Mutants: Molecular Basis For Their Inability To Function As Signal Switch Molecules" 96.51 166 99.40 99.40 1.12e-116 PDB 6Q21 "Molecular Switch For Signal Transduction: Structural Differences Between Active And Inactive Forms Of Protooncogenic Ras Protei" 96.51 171 100.00 100.00 1.76e-117 PDB 721P "Three-Dimensional Structures Of H-Ras P21 Mutants: Molecular Basis For Their Inability To Function As Signal Switch Molecules" 96.51 166 99.40 99.40 1.73e-116 PDB 821P "Three-Dimensional Structures And Properties Of A Transforming And A Nontransforming Glycine-12 Mutant Of P21h-Ras" 96.51 166 99.40 99.40 3.27e-116 DBJ BAB61869 "Rai-chu 101 [synthetic construct]" 97.09 740 99.40 100.00 2.07e-110 DBJ BAB61870 "Rai-chu 101X [synthetic construct]" 97.09 764 99.40 100.00 2.43e-110 DBJ BAB88314 "c-Ha-ras p21 protein [synthetic construct]" 96.51 189 100.00 100.00 8.75e-117 DBJ BAB88315 "c-Ha-ras p21 protein [synthetic construct]" 96.51 189 100.00 100.00 8.75e-117 DBJ BAB88316 "c-Ha-ras p21 protein [synthetic construct]" 96.51 189 100.00 100.00 8.75e-117 EMBL CAA25322 "transforming protein p21 [Moloney murine sarcoma virus]" 96.51 189 98.80 98.80 7.39e-115 EMBL CAA25624 "p21 protein [Homo sapiens]" 65.12 112 99.11 99.11 5.16e-74 EMBL CAA27258 "unnamed protein product [Gallus gallus]" 96.51 189 98.80 99.40 1.44e-115 EMBL CAA35240 "p21 ras [Bos taurus]" 55.81 96 97.92 98.96 4.34e-61 EMBL CAA90306 "C-H-Ras [Mus musculus]" 96.51 189 99.40 99.40 7.70e-116 GB AAA36554 "c-Ki-ras p21 protein, partial [Homo sapiens]" 55.81 96 97.92 97.92 2.34e-61 GB AAA42009 "c-ras-H-1 protein [Rattus norvegicus]" 96.51 189 100.00 100.00 6.04e-117 GB AAA46568 "transforming protein p21 has [Harvey murine sarcoma virus]" 96.51 241 98.19 98.19 6.45e-115 GB AAA46569 "protein p30 [Harvey murine sarcoma virus]" 96.51 241 98.19 98.19 6.45e-115 GB AAA46570 "p21 v-has transforming protein [Harvey murine sarcoma virus]" 96.51 189 98.19 98.19 4.34e-114 PIR A43816 "transforming protein ras - rabbit" 96.51 189 99.40 100.00 9.24e-117 PIR TVMVNS "transforming protein ras - NS.C58 murine sarcoma virus" 96.51 189 99.40 99.40 1.22e-115 PRF 0904302A protein,c-Ha-ras-1 96.51 189 99.40 99.40 1.65e-115 PRF 1604384A "ras oncogene" 96.51 189 97.59 97.59 2.01e-111 REF NP_001017003 "GTPase HRas [Xenopus (Silurana) tropicalis]" 96.51 189 98.80 99.40 1.13e-115 REF NP_001018465 "-Ha-ras Harvey rat sarcoma viral oncogene homolog b [Danio rerio]" 96.51 189 97.59 99.40 3.85e-114 REF NP_001084278 "Harvey rat sarcoma viral oncogene homolog [Xenopus laevis]" 96.51 189 98.80 99.40 1.13e-115 REF NP_001091711 "GTPase HRas precursor [Rattus norvegicus]" 96.51 189 100.00 100.00 8.75e-117 REF NP_001123913 "GTPase HRas precursor [Rattus norvegicus]" 96.51 189 100.00 100.00 8.75e-117 SP P01112 "RecName: Full=GTPase HRas; AltName: Full=H-Ras-1; AltName: Full=Ha-Ras; AltName: Full=Transforming protein p21; AltName: Full=c" 96.51 189 100.00 100.00 8.75e-117 SP P01113 "RecName: Full=GTPase HRas; AltName: Full=Transforming protein p21/H-Ras; Flags: Precursor" 96.51 189 98.80 99.40 2.45e-115 SP P01114 "RecName: Full=Transforming protein p29; Contains: RecName: Full=Transforming protein p21; Flags: Precursor" 96.51 248 98.19 98.19 1.70e-113 SP P01115 "RecName: Full=Transforming protein p29; Contains: RecName: Full=Transforming protein p21; Flags: Precursor" 96.51 241 98.19 98.19 6.45e-115 SP P08642 "RecName: Full=GTPase HRas; AltName: Full=H-Ras-1; AltName: Full=Transforming protein p21; AltName: Full=c-H-ras; AltName: Full=" 96.51 189 98.80 99.40 1.44e-115 TPG DAA13500 "TPA: v-Ha-ras Harvey rat sarcoma viral oncogene homolog [Bos taurus]" 96.51 189 98.80 99.40 5.69e-115 stop_ save_ save_entry_2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entry_2 _Molecular_mass . _Mol_thiol_state 'all free' _Details . _Residue_count . _Mol_residue_sequence ; XXXSNTIRVFLPNKQRTVVN VRNGMSLHDCLMKALKVRGL QPECCAVFRLLHEHKGKKAR LDWNTDAASLIGEELQVDF ; loop_ _Residue_seq_code _Residue_label 1 X 2 X 3 X 4 SER 5 ASN 6 THR 7 ILE 8 ARG 9 VAL 10 PHE 11 LEU 12 PRO 13 ASN 14 LYS 15 GLN 16 ARG 17 THR 18 VAL 19 VAL 20 ASN 21 VAL 22 ARG 23 ASN 24 GLY 25 MET 26 SER 27 LEU 28 HIS 29 ASP 30 CYS 31 LEU 32 MET 33 LYS 34 ALA 35 LEU 36 LYS 37 VAL 38 ARG 39 GLY 40 LEU 41 GLN 42 PRO 43 GLU 44 CYS 45 CYS 46 ALA 47 VAL 48 PHE 49 ARG 50 LEU 51 LEU 52 HIS 53 GLU 54 HIS 55 LYS 56 GLY 57 LYS 58 LYS 59 ALA 60 ARG 61 LEU 62 ASP 63 TRP 64 ASN 65 THR 66 ASP 67 ALA 68 ALA 69 SER 70 LEU 71 ILE 72 GLY 73 GLU 74 GLU 75 LEU 76 GLN 77 VAL 78 ASP 79 PHE stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ ############# # Ligands # ############# save_GNP _Saveframe_category ligand _Mol_type "non-polymer (NON-POLYMER)" _Name_common "entity_GNP (PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER)" _BMRB_code GNP _PDB_code GNP _Molecular_mass 522.196 _Mol_charge 0 _Mol_paramagnetic . _Mol_aromatic yes _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons C1' C1' C . 0 . ? C2 C2 C . 0 . ? C2' C2' C . 0 . ? C3' C3' C . 0 . ? C4 C4 C . 0 . ? C4' C4' C . 0 . ? C5 C5 C . 0 . ? C5' C5' C . 0 . ? C6 C6 C . 0 . ? C8 C8 C . 0 . ? H1' H1' H . 0 . ? H2' H2' H . 0 . ? H3' H3' H . 0 . ? H4' H4' H . 0 . ? H5'1 H5'1 H . 0 . ? H5'2 H5'2 H . 0 . ? H8 H8 H . 0 . ? HN1 HN1 H . 0 . ? HN21 HN21 H . 0 . ? HN22 HN22 H . 0 . ? HNB3 HNB3 H . 0 . ? HO2' HO2' H . 0 . ? HO3' HO3' H . 0 . ? HOA2 HOA2 H . 0 . ? HOB2 HOB2 H . 0 . ? HOG2 HOG2 H . 0 . ? HOG3 HOG3 H . 0 . ? N1 N1 N . 0 . ? N2 N2 N . 0 . ? N3 N3 N . 0 . ? N3B N3B N . 0 . ? N7 N7 N . 0 . ? N9 N9 N . 0 . ? O1A O1A O . 0 . ? O1B O1B O . 0 . ? O1G O1G O . 0 . ? O2' O2' O . 0 . ? O2A O2A O . 0 . ? O2B O2B O . 0 . ? O2G O2G O . 0 . ? O3' O3' O . 0 . ? O3A O3A O . 0 . ? O3G O3G O . 0 . ? O4' O4' O . 0 . ? O5' O5' O . 0 . ? O6 O6 O . 0 . ? PA PA P . 0 . ? PB PB P . 0 . ? PG PG P . 0 . ? stop_ loop_ _Bond_order _Bond_atom_one_atom_name _Bond_atom_two_atom_name _PDB_bond_atom_one_atom_name _PDB_bond_atom_two_atom_name DOUB PG O1G ? ? SING PG O2G ? ? SING PG O3G ? ? SING PG N3B ? ? SING O2G HOG2 ? ? SING O3G HOG3 ? ? SING N3B PB ? ? SING N3B HNB3 ? ? DOUB PB O1B ? ? SING PB O2B ? ? SING PB O3A ? ? SING O2B HOB2 ? ? SING O3A PA ? ? DOUB PA O1A ? ? SING PA O2A ? ? SING PA O5' ? ? SING O2A HOA2 ? ? SING O5' C5' ? ? SING C5' C4' ? ? SING C5' H5'2 ? ? SING C5' H5'1 ? ? SING C4' O4' ? ? SING C4' C3' ? ? SING C4' H4' ? ? SING O4' C1' ? ? SING C3' O3' ? ? SING C3' C2' ? ? SING C3' H3' ? ? SING O3' HO3' ? ? SING C2' O2' ? ? SING C2' C1' ? ? SING C2' H2' ? ? SING O2' HO2' ? ? SING C1' N9 ? ? SING C1' H1' ? ? SING N9 C8 ? ? SING N9 C4 ? ? DOUB C8 N7 ? ? SING C8 H8 ? ? SING N7 C5 ? ? SING C5 C6 ? ? DOUB C5 C4 ? ? DOUB C6 O6 ? ? SING C6 N1 ? ? SING N1 C2 ? ? SING N1 HN1 ? ? SING C2 N2 ? ? DOUB C2 N3 ? ? SING N2 HN21 ? ? SING N2 HN22 ? ? SING N3 C4 ? ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ save_MG _Saveframe_category ligand _Mol_type "non-polymer (NON-POLYMER)" _Name_common "entity_MG (MAGNESIUM ION)" _BMRB_code MG _PDB_code MG _Molecular_mass 24.305 _Mol_charge 2 _Mol_paramagnetic . _Mol_aromatic no _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons MG MG MG . 2 . ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $entity_1 'recombinant technology' . Escherichia coli . pGEX-6P stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1-2 mM '[U-98% 13C; U-98% 15N]' $entity_GNP 1-2 mM 'natural abundance' $entity_MG 10 mM 'natural abundance' 'sodium chloride' 150 mM 'natural abundance' 'sodium phosphate' 25 mM 'natural abundance' $entry_2 1-2 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1-2 mM '[U-98% 15N]' $entity_GNP 1-2 mM 'natural abundance' $entity_MG 10 mM 'natural abundance' 'sodium chloride' 150 mM 'natural abundance' 'sodium phosphate' 25 mM 'natural abundance' $entry_2 1-2 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'peak picking' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 750 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HNCA_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_2 save_ save_3D_1H-15N_NOESY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_2 save_ save_NMR_spectrometer_expt _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units temperature 298 . K pH 6.8 . pH pressure 1 . atm 'ionic strength' 0.24 . M stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio TSP H 1 'methyl protons' ppm 0.00 external indirect . . . 1.000000000 TSP C 13 'methyl protons' ppm 0.00 external indirect . . . 0.251449530 TSP N 15 'methyl protons' ppm 0.00 external indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '3D HNCA' '3D HN(CO)CA' '2D 1H-15N HSQC' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name H-Ras-GppNHp _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 1 7 MET H H 8.119 0.001 1 2 1 7 MET CA C 55.362 0.013 1 3 1 7 MET N N 121.510 0.038 1 4 2 8 THR H H 8.763 0.004 1 5 2 8 THR CA C 63.733 0.013 1 6 2 8 THR N N 124.505 0.078 1 7 3 9 GLU H H 8.341 0.004 1 8 3 9 GLU CA C 53.596 0.009 1 9 3 9 GLU N N 127.503 0.077 1 10 4 10 TYR H H 8.703 0.002 1 11 4 10 TYR CA C 56.799 0.040 1 12 4 10 TYR N N 123.675 0.017 1 13 5 11 LYS H H 9.145 0.009 1 14 5 11 LYS CA C 55.551 0.115 1 15 5 11 LYS N N 125.039 0.126 1 16 6 12 LEU H H 9.256 0.009 1 17 6 12 LEU CA C 52.931 0.041 1 18 6 12 LEU N N 126.645 0.036 1 19 7 13 VAL H H 8.194 0.008 1 20 7 13 VAL CA C 60.811 0.111 1 21 7 13 VAL N N 123.582 0.158 1 22 8 14 VAL H H 9.043 0.003 1 23 8 14 VAL CA C 62.047 0.095 1 24 8 14 VAL N N 130.900 0.034 1 25 9 15 VAL H H 9.144 0.006 1 26 9 15 VAL CA C 58.630 0.000 1 27 9 15 VAL N N 121.328 0.270 1 28 10 16 GLY H H 7.697 0.002 1 29 10 16 GLY CA C 43.745 0.000 1 30 10 16 GLY N N 109.683 0.158 1 31 11 17 ALA H H 9.067 0.007 1 32 11 17 ALA CA C 52.278 0.086 1 33 11 17 ALA N N 122.301 0.029 1 34 12 18 GLY H H 8.378 0.004 1 35 12 18 GLY CA C 46.378 0.000 1 36 12 18 GLY N N 106.661 0.031 1 37 13 19 GLY H H 9.165 0.011 1 38 13 19 GLY CA C 45.947 0.007 1 39 13 19 GLY N N 115.221 0.174 1 40 14 20 VAL H H 7.443 0.003 1 41 14 20 VAL CA C 62.801 0.000 1 42 14 20 VAL N N 113.751 0.021 1 43 15 21 GLY H H 8.283 0.000 1 44 15 21 GLY CA C 45.908 0.027 1 45 15 21 GLY N N 109.258 0.104 1 46 16 22 LYS H H 8.884 0.002 1 47 16 22 LYS CA C 61.077 0.020 1 48 16 22 LYS N N 124.252 0.133 1 49 17 23 SER H H 9.411 0.011 1 50 17 23 SER CA C 60.718 0.246 1 51 17 23 SER N N 121.357 0.164 1 52 18 24 ALA H H 9.683 0.010 1 53 18 24 ALA CA C 54.204 0.089 1 54 18 24 ALA N N 127.285 0.047 1 55 19 25 LEU H H 8.856 0.010 1 56 19 25 LEU CA C 58.673 0.056 1 57 19 25 LEU N N 121.455 0.031 1 58 20 26 THR H H 7.688 0.004 1 59 20 26 THR CA C 68.165 0.000 1 60 20 26 THR N N 118.475 0.016 1 61 21 27 ILE H H 9.308 0.002 1 62 21 27 ILE CA C 65.137 0.000 1 63 21 27 ILE N N 122.611 0.081 1 64 22 28 GLN H H 7.862 0.012 1 65 22 28 GLN CA C 59.165 0.046 1 66 22 28 GLN N N 122.132 0.089 1 67 23 29 LEU H H 7.646 0.003 1 68 23 29 LEU CA C 58.101 0.000 1 69 23 29 LEU N N 122.543 0.031 1 70 24 30 ILE H H 8.133 0.002 1 71 24 30 ILE CA C 62.290 0.047 1 72 24 30 ILE N N 115.400 0.093 1 73 25 31 GLN H H 9.006 0.002 1 74 25 31 GLN CA C 54.280 0.000 1 75 25 31 GLN N N 120.136 0.011 1 76 26 32 ASN H H 8.106 0.000 1 77 26 32 ASN CA C 54.372 0.000 1 78 26 32 ASN N N 118.387 0.000 1 79 27 33 HIS H H 6.686 0.002 1 80 27 33 HIS CA C 54.655 0.095 1 81 27 33 HIS N N 114.840 0.085 1 82 28 34 PHE H H 8.321 0.002 1 83 28 34 PHE CA C 54.562 0.112 1 84 28 34 PHE N N 125.392 0.115 1 85 29 35 VAL H H 7.741 0.025 1 86 29 35 VAL CA C 59.269 0.000 1 87 29 35 VAL N N 128.385 0.268 1 88 30 36 ASP H H 7.788 0.001 1 89 30 36 ASP CA C 54.579 0.000 1 90 30 36 ASP N N 125.202 0.321 1 91 31 37 GLU CA C 55.870 0.000 1 92 32 38 TYR H H 8.843 0.003 1 93 32 38 TYR CA C 54.429 0.000 1 94 32 38 TYR N N 124.023 0.196 1 95 33 39 ASP H H 8.258 0.002 1 96 33 39 ASP N N 121.636 0.083 1 97 35 41 THR H H 9.998 0.001 1 98 35 41 THR CA C 63.940 0.000 1 99 35 41 THR N N 127.575 0.230 1 100 36 42 ILE H H 8.623 0.000 1 101 36 42 ILE CA C 64.388 0.061 1 102 36 42 ILE N N 125.154 0.024 1 103 37 43 GLU H H 7.869 0.006 1 104 37 43 GLU CA C 57.675 0.008 1 105 37 43 GLU N N 119.193 0.124 1 106 38 44 ASP H H 8.017 0.002 1 107 38 44 ASP CA C 54.593 0.053 1 108 38 44 ASP N N 126.929 0.144 1 109 39 45 SER H H 9.087 0.008 1 110 39 45 SER CA C 55.869 0.015 1 111 39 45 SER N N 117.442 0.144 1 112 40 46 TYR H H 9.203 0.005 1 113 40 46 TYR CA C 56.553 0.066 1 114 40 46 TYR N N 122.104 0.108 1 115 41 47 ARG H H 8.247 0.008 1 116 41 47 ARG CA C 54.134 0.005 1 117 41 47 ARG N N 121.363 0.035 1 118 42 48 LYS H H 8.787 0.003 1 119 42 48 LYS CA C 55.462 0.078 1 120 42 48 LYS N N 125.038 0.067 1 121 43 49 GLN H H 8.950 0.004 1 122 43 49 GLN CA C 55.540 0.047 1 123 43 49 GLN N N 130.685 0.082 1 124 44 50 VAL H H 9.101 0.004 1 125 44 50 VAL CA C 59.451 0.005 1 126 44 50 VAL N N 121.818 0.122 1 127 45 51 VAL H H 8.081 0.003 1 128 45 51 VAL CA C 61.654 0.112 1 129 45 51 VAL N N 122.107 0.092 1 130 46 52 ILE H H 8.195 0.005 1 131 46 52 ILE CA C 60.249 0.143 1 132 46 52 ILE N N 126.799 0.119 1 133 47 53 ASP H H 9.568 0.017 1 134 47 53 ASP CA C 55.243 0.019 1 135 47 53 ASP N N 131.892 0.066 1 136 48 54 GLY H H 8.346 0.002 1 137 48 54 GLY CA C 45.148 0.014 1 138 48 54 GLY N N 104.410 0.100 1 139 49 55 GLU H H 7.705 0.008 1 140 49 55 GLU CA C 54.683 0.055 1 141 49 55 GLU N N 123.609 0.072 1 142 50 56 THR H H 8.962 0.005 1 143 50 56 THR CA C 63.727 0.022 1 144 50 56 THR N N 126.953 0.089 1 145 51 57 CYS H H 9.472 0.009 1 146 51 57 CYS CA C 56.338 0.007 1 147 51 57 CYS N N 124.896 0.273 1 148 52 58 LEU H H 8.832 0.001 1 149 52 58 LEU CA C 53.443 0.039 1 150 52 58 LEU N N 123.305 0.093 1 151 53 59 LEU H H 9.065 0.004 1 152 53 59 LEU CA C 53.520 0.000 1 153 53 59 LEU N N 124.300 0.046 1 154 54 60 ASP H H 8.910 0.003 1 155 54 60 ASP CA C 53.096 0.210 1 156 54 60 ASP N N 127.880 0.009 1 157 55 61 ILE H H 9.596 0.006 1 158 55 61 ILE CA C 60.660 0.000 1 159 55 61 ILE N N 126.166 0.055 1 160 56 62 LEU H H 9.030 0.003 1 161 56 62 LEU CA C 53.882 0.000 1 162 56 62 LEU N N 130.877 0.006 1 163 57 63 ASP H H 9.500 0.014 1 164 57 63 ASP CA C 53.489 0.069 1 165 57 63 ASP N N 130.740 0.038 1 166 58 64 THR H H 6.848 0.004 1 167 58 64 THR CA C 60.138 0.034 1 168 58 64 THR N N 112.651 0.061 1 169 59 65 ALA H H 7.595 0.025 1 170 59 65 ALA CA C 52.364 0.086 1 171 59 65 ALA N N 121.334 0.096 1 172 60 66 GLY H H 9.502 0.006 1 173 60 66 GLY CA C 45.780 0.000 1 174 60 66 GLY N N 116.005 0.048 1 175 61 67 GLN H H 8.411 0.008 1 176 61 67 GLN CA C 56.661 0.066 1 177 61 67 GLN N N 121.490 0.035 1 178 62 68 GLU H H 8.919 0.007 1 179 62 68 GLU CA C 58.700 0.065 1 180 62 68 GLU N N 126.125 0.091 1 181 63 69 GLU H H 9.136 0.006 1 182 63 69 GLU N N 121.768 0.081 1 183 64 70 TYR H H 7.743 0.000 1 184 64 70 TYR CA C 57.418 0.078 1 185 64 70 TYR N N 119.251 0.098 1 186 65 71 SER H H 7.992 0.007 1 187 65 71 SER CA C 60.920 0.026 1 188 65 71 SER N N 119.075 0.129 1 189 66 72 ALA H H 8.713 0.003 1 190 66 72 ALA CA C 54.400 0.101 1 191 66 72 ALA N N 126.106 0.074 1 192 67 73 MET H H 7.905 0.004 1 193 67 73 MET CA C 56.841 0.054 1 194 67 73 MET N N 117.330 0.042 1 195 68 74 ARG H H 7.695 0.003 1 196 68 74 ARG CA C 58.843 0.108 1 197 68 74 ARG N N 120.157 0.263 1 198 69 75 ASP H H 8.076 0.004 1 199 69 75 ASP CA C 57.668 0.009 1 200 69 75 ASP N N 118.962 0.070 1 201 70 76 GLN H H 7.677 0.001 1 202 70 76 GLN CA C 58.818 0.000 1 203 70 76 GLN N N 117.236 0.120 1 204 71 77 TYR H H 7.625 0.002 1 205 71 77 TYR CA C 58.502 0.000 1 206 71 77 TYR N N 117.420 0.009 1 207 72 78 MET H H 8.363 0.002 1 208 72 78 MET CA C 59.114 0.046 1 209 72 78 MET N N 122.385 0.047 1 210 73 79 ARG H H 7.805 0.016 1 211 73 79 ARG CA C 59.579 0.004 1 212 73 79 ARG N N 118.215 0.142 1 213 74 80 THR H H 7.464 0.004 1 214 74 80 THR CA C 62.570 0.017 1 215 74 80 THR N N 108.133 0.105 1 216 75 81 GLY H H 7.720 0.001 1 217 75 81 GLY CA C 46.424 0.031 1 218 75 81 GLY N N 108.531 0.170 1 219 76 82 GLU H H 8.798 0.009 1 220 76 82 GLU CA C 56.468 0.142 1 221 76 82 GLU N N 122.178 0.107 1 222 77 83 GLY H H 7.235 0.020 1 223 77 83 GLY CA C 45.429 0.076 1 224 77 83 GLY N N 102.632 0.119 1 225 78 84 PHE H H 8.245 0.002 1 226 78 84 PHE CA C 56.893 0.109 1 227 78 84 PHE N N 122.441 0.140 1 228 79 85 LEU H H 9.260 0.016 1 229 79 85 LEU CA C 54.031 0.127 1 230 79 85 LEU N N 128.124 0.072 1 231 80 86 CYS H H 8.763 0.001 1 232 80 86 CYS CA C 57.669 0.019 1 233 80 86 CYS N N 125.795 0.173 1 234 81 87 VAL H H 9.129 0.001 1 235 81 87 VAL CA C 61.310 0.141 1 236 81 87 VAL N N 127.259 0.094 1 237 82 88 PHE H H 9.272 0.007 1 238 82 88 PHE CA C 55.336 0.011 1 239 82 88 PHE N N 124.992 0.098 1 240 83 89 ALA H H 8.688 0.009 1 241 83 89 ALA CA C 49.670 0.011 1 242 83 89 ALA N N 122.112 0.266 1 243 84 90 ILE H H 8.525 0.004 1 244 84 90 ILE CA C 63.300 0.045 1 245 84 90 ILE N N 114.661 0.110 1 246 85 91 ASN H H 7.898 0.002 1 247 85 91 ASN CA C 52.019 0.094 1 248 85 91 ASN N N 118.132 0.032 1 249 86 92 ASN H H 7.933 0.002 1 250 86 92 ASN CA C 51.803 0.000 1 251 86 92 ASN N N 120.412 0.006 1 252 87 93 THR H H 9.271 0.000 1 253 87 93 THR CA C 66.708 0.000 1 254 87 93 THR N N 125.587 0.000 1 255 88 94 LYS H H 8.458 0.006 1 256 88 94 LYS CA C 59.334 0.087 1 257 88 94 LYS N N 125.329 0.059 1 258 89 95 SER H H 8.006 0.003 1 259 89 95 SER CA C 61.615 0.000 1 260 89 95 SER N N 115.547 0.233 1 261 90 96 PHE H H 7.447 0.004 1 262 90 96 PHE CA C 59.624 0.193 1 263 90 96 PHE N N 126.142 0.012 1 264 91 97 GLU H H 8.398 0.016 1 265 91 97 GLU CA C 59.102 0.000 1 266 91 97 GLU N N 122.769 0.081 1 267 92 98 ASP H H 8.601 0.006 1 268 92 98 ASP CA C 56.340 0.044 1 269 92 98 ASP N N 119.097 0.016 1 270 93 99 ILE H H 7.596 0.005 1 271 93 99 ILE CA C 62.100 0.022 1 272 93 99 ILE N N 121.598 0.067 1 273 94 100 HIS H H 7.746 0.001 1 274 94 100 HIS CA C 59.892 0.085 1 275 94 100 HIS N N 118.606 0.117 1 276 95 101 GLN H H 7.427 0.003 1 277 95 101 GLN CA C 58.382 0.024 1 278 95 101 GLN N N 117.455 0.045 1 279 96 102 TYR H H 7.642 0.006 1 280 96 102 TYR CA C 63.128 0.000 1 281 96 102 TYR N N 120.251 0.083 1 282 97 103 ARG H H 8.416 0.005 1 283 97 103 ARG CA C 59.990 0.067 1 284 97 103 ARG N N 119.948 0.023 1 285 98 104 GLU H H 8.007 0.004 1 286 98 104 GLU CA C 58.974 0.072 1 287 98 104 GLU N N 118.060 0.070 1 288 99 105 GLN H H 7.903 0.004 1 289 99 105 GLN CA C 59.157 0.006 1 290 99 105 GLN N N 121.823 0.083 1 291 100 106 ILE H H 8.083 0.000 1 292 100 106 ILE CA C 66.005 0.042 1 293 100 106 ILE N N 121.317 0.047 1 294 101 107 LYS H H 7.805 0.004 1 295 101 107 LYS CA C 59.573 0.002 1 296 101 107 LYS N N 118.153 0.032 1 297 102 108 ARG H H 7.753 0.003 1 298 102 108 ARG CA C 59.203 0.064 1 299 102 108 ARG N N 119.788 0.262 1 300 103 109 VAL H H 8.428 0.012 1 301 103 109 VAL CA C 65.517 0.131 1 302 103 109 VAL N N 119.549 0.130 1 303 104 110 LYS H H 8.166 0.006 1 304 104 110 LYS CA C 55.020 0.020 1 305 104 110 LYS N N 117.298 0.026 1 306 105 111 ASP H H 7.938 0.002 1 307 105 111 ASP CA C 54.454 0.006 1 308 105 111 ASP N N 122.165 0.089 1 309 106 112 SER H H 7.555 0.004 1 310 106 112 SER CA C 56.774 0.040 1 311 106 112 SER N N 110.342 0.030 1 312 107 113 ASP H H 8.395 0.006 1 313 107 113 ASP CA C 54.331 0.052 1 314 107 113 ASP N N 123.525 0.000 1 315 108 114 ASP H H 8.427 0.003 1 316 108 114 ASP CA C 53.048 0.004 1 317 108 114 ASP N N 122.282 0.010 1 318 109 115 VAL H H 7.649 0.001 1 319 109 115 VAL CA C 59.131 0.000 1 320 109 115 VAL N N 123.666 0.024 1 321 110 116 PRO CA C 63.866 0.000 1 322 111 117 MET H H 8.310 0.005 1 323 111 117 MET CA C 54.933 0.000 1 324 111 117 MET N N 124.340 0.068 1 325 112 118 VAL H H 8.149 0.000 1 326 112 118 VAL CA C 61.012 0.014 1 327 112 118 VAL N N 119.802 0.038 1 328 113 119 LEU H H 8.914 0.007 1 329 113 119 LEU CA C 53.877 0.031 1 330 113 119 LEU N N 130.172 0.150 1 331 114 120 VAL H H 9.229 0.004 1 332 114 120 VAL CA C 60.094 0.010 1 333 114 120 VAL N N 129.484 0.127 1 334 115 121 GLY H H 8.059 0.002 1 335 115 121 GLY CA C 45.271 0.000 1 336 115 121 GLY N N 115.904 0.205 1 337 116 122 ASN H H 8.733 0.006 1 338 116 122 ASN CA C 51.398 0.000 1 339 116 122 ASN N N 122.414 0.035 1 340 117 123 LYS H H 7.344 0.005 1 341 117 123 LYS CA C 57.274 0.082 1 342 117 123 LYS N N 113.325 0.023 1 343 118 124 CYS H H 8.696 0.006 1 344 118 124 CYS CA C 60.962 0.000 1 345 118 124 CYS N N 115.196 0.047 1 346 119 125 ASP H H 8.575 0.006 1 347 119 125 ASP CA C 53.950 0.002 1 348 119 125 ASP N N 118.325 0.099 1 349 120 126 LEU H H 7.792 0.004 1 350 120 126 LEU CA C 54.648 0.079 1 351 120 126 LEU N N 122.072 0.085 1 352 121 127 ALA H H 8.156 0.005 1 353 121 127 ALA CA C 53.019 0.011 1 354 121 127 ALA N N 123.996 0.052 1 355 122 128 ALA H H 7.703 0.002 1 356 122 128 ALA CA C 51.182 0.003 1 357 122 128 ALA N N 123.006 0.052 1 358 123 129 ARG H H 7.990 0.003 1 359 123 129 ARG CA C 55.677 0.000 1 360 123 129 ARG N N 121.475 0.022 1 361 124 130 THR H H 9.153 0.000 1 362 124 130 THR CA C 61.684 0.000 1 363 124 130 THR N N 115.855 0.000 1 364 125 131 VAL H H 7.640 0.003 1 365 125 131 VAL CA C 61.442 0.040 1 366 125 131 VAL N N 125.744 0.044 1 367 126 132 GLU H H 8.743 0.001 1 368 126 132 GLU CA C 56.233 0.014 1 369 126 132 GLU N N 128.311 0.057 1 370 127 133 SER H H 9.426 0.005 1 371 127 133 SER CA C 62.850 0.028 1 372 127 133 SER N N 122.918 0.045 1 373 128 134 ARG H H 8.678 0.002 1 374 128 134 ARG CA C 58.728 0.014 1 375 128 134 ARG N N 119.078 0.039 1 376 129 135 GLN H H 6.798 0.004 1 377 129 135 GLN CA C 58.468 0.002 1 378 129 135 GLN N N 117.957 0.090 1 379 130 136 ALA H H 7.020 0.002 1 380 130 136 ALA CA C 54.844 0.035 1 381 130 136 ALA N N 124.658 0.039 1 382 131 137 GLN H H 8.610 0.006 1 383 131 137 GLN CA C 58.912 0.031 1 384 131 137 GLN N N 119.218 0.054 1 385 132 138 ASP H H 8.237 0.001 1 386 132 138 ASP CA C 57.213 0.013 1 387 132 138 ASP N N 121.337 0.048 1 388 133 139 LEU H H 7.480 0.004 1 389 133 139 LEU CA C 57.615 0.017 1 390 133 139 LEU N N 124.742 0.028 1 391 134 140 ALA H H 8.414 0.004 1 392 134 140 ALA CA C 55.818 0.044 1 393 134 140 ALA N N 122.886 0.022 1 394 135 141 ARG H H 8.466 0.007 1 395 135 141 ARG CA C 59.324 0.020 1 396 135 141 ARG N N 119.630 0.050 1 397 136 142 SER H H 7.958 0.003 1 398 136 142 SER CA C 61.459 0.042 1 399 136 142 SER N N 118.986 0.066 1 400 137 143 TYR H H 7.692 0.001 1 401 137 143 TYR CA C 54.605 0.006 1 402 137 143 TYR N N 121.420 0.051 1 403 138 144 GLY H H 8.340 0.007 1 404 138 144 GLY CA C 46.416 0.036 1 405 138 144 GLY N N 112.232 0.084 1 406 139 145 ILE H H 8.066 0.003 1 407 139 145 ILE CA C 58.467 0.000 1 408 139 145 ILE N N 114.226 0.023 1 409 140 146 PRO CA C 62.403 0.000 1 410 141 147 TYR H H 8.247 0.004 1 411 141 147 TYR CA C 54.860 0.002 1 412 141 147 TYR N N 121.180 0.111 1 413 142 148 ILE H H 8.522 0.002 1 414 142 148 ILE CA C 59.215 0.024 1 415 142 148 ILE N N 131.299 0.140 1 416 143 149 GLU H H 7.836 0.003 1 417 143 149 GLU CA C 55.717 0.030 1 418 143 149 GLU N N 126.099 0.053 1 419 144 150 THR H H 8.837 0.006 1 420 144 150 THR CA C 59.483 0.042 1 421 144 150 THR N N 114.073 0.112 1 422 145 151 SER H H 8.743 0.006 1 423 145 151 SER CA C 57.391 0.033 1 424 145 151 SER N N 113.500 0.068 1 425 146 152 ALA H H 9.162 0.006 1 426 146 152 ALA CA C 54.397 0.087 1 427 146 152 ALA N N 133.327 0.080 1 428 147 153 LYS H H 7.031 0.006 1 429 147 153 LYS CA C 58.215 0.054 1 430 147 153 LYS N N 117.634 0.062 1 431 148 154 THR H H 7.613 0.003 1 432 148 154 THR CA C 61.304 0.052 1 433 148 154 THR N N 107.247 0.138 1 434 149 155 ARG H H 7.742 0.005 1 435 149 155 ARG CA C 59.313 0.125 1 436 149 155 ARG N N 120.000 0.512 1 437 150 156 GLN H H 7.832 0.002 1 438 150 156 GLN CA C 57.210 0.015 1 439 150 156 GLN N N 125.338 0.060 1 440 151 157 GLY H H 8.945 0.001 1 441 151 157 GLY CA C 46.829 0.061 1 442 151 157 GLY N N 116.351 0.039 1 443 152 158 VAL H H 7.067 0.002 1 444 152 158 VAL CA C 68.252 0.076 1 445 152 158 VAL N N 121.823 0.265 1 446 153 159 GLU H H 8.183 0.004 1 447 153 159 GLU CA C 60.404 0.030 1 448 153 159 GLU N N 117.913 0.042 1 449 154 160 ASP H H 8.147 0.005 1 450 154 160 ASP CA C 57.178 0.019 1 451 154 160 ASP N N 117.433 0.090 1 452 155 161 ALA H H 8.593 0.010 1 453 155 161 ALA CA C 56.248 0.054 1 454 155 161 ALA N N 125.240 0.040 1 455 156 162 PHE H H 7.212 0.002 1 456 156 162 PHE CA C 62.942 0.050 1 457 156 162 PHE N N 113.807 0.069 1 458 157 163 TYR H H 9.601 0.005 1 459 157 163 TYR CA C 58.407 0.033 1 460 157 163 TYR N N 120.265 0.031 1 461 158 164 THR H H 8.541 0.008 1 462 158 164 THR CA C 67.622 0.035 1 463 158 164 THR N N 118.168 0.180 1 464 159 165 LEU H H 7.237 0.009 1 465 159 165 LEU CA C 57.959 0.061 1 466 159 165 LEU N N 122.821 0.081 1 467 160 166 VAL H H 7.536 0.003 1 468 160 166 VAL CA C 67.529 0.025 1 469 160 166 VAL N N 120.243 0.103 1 470 161 167 ARG H H 8.094 0.004 1 471 161 167 ARG CA C 60.962 0.058 1 472 161 167 ARG N N 120.209 0.037 1 473 162 168 GLU H H 8.218 0.002 1 474 162 168 GLU CA C 58.692 0.016 1 475 162 168 GLU N N 119.421 0.098 1 476 163 169 ILE H H 8.185 0.003 1 477 163 169 ILE CA C 65.931 0.064 1 478 163 169 ILE N N 123.198 0.142 1 479 164 170 ARG H H 8.461 0.005 1 480 164 170 ARG CA C 59.148 0.095 1 481 164 170 ARG N N 119.867 0.105 1 482 165 171 GLN H H 7.666 0.002 1 483 165 171 GLN CA C 55.916 0.011 1 484 165 171 GLN N N 116.584 0.012 1 485 166 172 HIS H H 7.711 0.002 1 486 166 172 HIS CA C 58.130 0.000 1 487 166 172 HIS N N 126.040 0.082 1 stop_ save_ save_heteronuclear_T1_list_1 _Saveframe_category T1_relaxation _Details . loop_ _Sample_label $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Spectrometer_frequency_1H 749.93 _T1_coherence_type Sz _T1_value_units s _Mol_system_component_name H-Ras-GppNHp _Text_data_format . _Text_data . loop_ _T1_ID _Residue_seq_code _Residue_label _Atom_name _T1_value _T1_value_error 1 7 MET N 0.845682 0.0172 2 8 THR N 1.19297 0.0399 3 9 GLU N 1.70452 0.0845 4 10 TYR N 1.38351 0.0776 5 11 LYS N 2.36983 0.419 6 12 LEU N 2.10371 0.27 7 15 VAL N 1.56063 0.049 8 16 GLY N 2.3279 0.139 9 18 GLY N 2.01738 0.224 10 19 GLY N 1.1907 0.141 11 20 VAL N 1.47817 0.0657 12 21 GLY N 2.23354 0.371 13 22 LYS N 0.98194 0.114 14 23 SER N 1.44074 0.097 15 24 ALA N 1.62526 0.0942 16 25 LEU N 1.51972 0.09 17 26 THR N 1.39538 0.0874 18 27 ILE N 1.53964 0.208 19 28 GLN N 1.41729 0.0769 20 29 LEU N 1.68484 0.125 21 30 ILE N 1.32466 0.0892 22 31 GLN N 1.48098 0.175 23 32 ASN N 1.38549 0.0949 24 33 HIS N 1.4632 0.0307 25 34 PHE N 1.26483 0.153 26 35 VAL N 1.25769 0.333 27 36 ASP N 1.4626 0.242 28 41 THR N 1.53221 0.464 29 43 GLU N 1.89465 0.164 30 44 ASP N 1.74605 0.274 31 45 SER N 2.07378 0.237 32 46 TYR N 1.45448 0.174 33 48 LYS N 1.84547 0.0474 34 49 GLN N 1.63012 0.162 35 50 VAL N 1.46808 0.0643 36 51 VAL N 1.50133 0.0602 37 52 ILE N 1.72172 0.134 38 53 ASP N 1.45393 0.159 39 54 GLY N 1.3715 0.0641 40 55 GLU N 1.67169 0.0834 41 56 THR N 1.36371 0.121 42 57 CYS N 1.43987 0.0555 43 59 LEU N 1.60203 0.133 44 60 ASP N 1.80452 0.23 45 61 ILE N 1.64134 0.103 46 63 ASP N 1.61917 0.255 47 66 GLY N 1.72954 0.252 48 67 GLN N 1.27484 0.0442 49 68 GLU N 1.25772 0.142 50 69 GLU N 1.24333 0.072 51 72 ALA N 1.16218 0.0532 52 73 MET N 1.0799 0.0394 53 74 ARG N 1.2358 0.0593 54 75 ASP N 1.34778 0.044 55 76 GLN N 1.37011 0.0565 56 77 TYR N 1.4052 0.0327 57 78 MET N 1.44685 0.0982 58 80 THR N 1.23269 0.0437 59 81 GLY N 1.27963 0.0687 60 82 GLU N 1.51586 0.234 61 83 GLY N 1.84993 0.0911 62 84 PHE N 1.76439 0.188 63 85 LEU N 2.03589 0.278 64 86 CYS N 2.03484 0.249 65 87 VAL N 2.12456 0.135 66 88 PHE N 1.80542 0.0659 67 89 ALA N 1.37598 0.173 68 90 ILE N 1.66564 0.216 69 91 ASN N 1.58902 0.0845 70 92 ASN N 1.52626 0.0711 71 94 LYS N 1.31551 0.0637 72 95 SER N 1.54189 0.0653 73 96 PHE N 1.63099 0.116 74 99 ILE N 1.64602 0.074 75 100 HIS N 1.35888 0.052 76 101 GLN N 1.48512 0.0462 77 102 TYR N 1.63984 0.0601 78 104 GLU N 1.54437 0.0718 79 105 GLN N 1.53526 0.0846 80 108 ARG N 1.58768 0.0649 81 109 VAL N 1.62144 0.0654 82 111 ASP N 1.38668 0.0619 83 112 SER N 1.59225 0.0364 84 113 ASP N 0.946157 0.0289 85 114 ASP N 1.301 0.0344 86 115 VAL N 1.24402 0.0383 87 117 MET N 1.69858 0.123 88 118 VAL N 1.84215 0.121 89 119 LEU N 1.48691 0.0848 90 120 VAL N 1.96496 0.206 91 121 GLY N 1.45596 0.0829 92 122 ASN N 1.69353 0.191 93 124 CYS N 1.53359 0.084 94 125 ASP N 1.44751 0.0734 95 126 LEU N 1.57147 0.141 96 127 ALA N 1.51089 0.0667 97 128 ALA N 1.57792 0.0632 98 129 ARG N 1.75452 0.0572 99 130 THR N 1.72167 0.265 100 131 VAL N 1.64597 0.135 101 132 GLU N 1.63146 0.114 102 133 SER N 1.31415 0.0687 103 134 ARG N 1.48956 0.0788 104 135 GLN N 1.54398 0.035 105 136 ALA N 1.58563 0.0416 106 139 LEU N 1.84756 0.0912 107 140 ALA N 1.55322 0.0558 108 141 ARG N 1.59529 0.0906 109 143 TYR N 1.48688 0.072 110 144 GLY N 1.67309 0.0977 111 145 ILE N 1.51368 0.0935 112 148 ILE N 1.62981 0.0678 113 149 GLU N 1.75882 0.0722 114 150 THR N 1.52771 0.0921 115 151 SER N 1.71872 0.126 116 152 ALA N 1.55066 0.183 117 153 LYS N 1.58405 0.0649 118 154 THR N 1.57106 0.157 119 155 ARG N 1.42571 0.135 120 156 GLN N 1.59286 0.07 121 157 GLY N 1.36525 0.11 122 158 VAL N 1.4493 0.0329 123 159 GLU N 1.61787 0.0697 124 161 ALA N 1.61448 0.0589 125 162 PHE N 1.50657 0.116 126 163 TYR N 1.58609 0.0953 127 164 THR N 1.74722 0.0795 128 165 LEU N 1.65289 0.0581 129 166 VAL N 1.62781 0.0772 130 167 ARG N 1.42844 0.126 131 168 GLU N 1.70728 0.145 132 170 ARG N 1.55577 0.128 133 171 GLN N 1.48826 0.054 134 172 HIS N 1.16444 0.0287 stop_ save_ save_heteronuclear_T2_list_1 _Saveframe_category T2_relaxation _Details . loop_ _Sample_label $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Spectrometer_frequency_1H 749.93 _T2_coherence_type S(+,-) _T2_value_units ms _Mol_system_component_name H-Ras-GppNHp _Text_data_format . _Text_data . loop_ _T2_ID _Residue_seq_code _Residue_label _Atom_name _T2_value _T2_value_error _Rex_value _Rex_error 1 7 MET N 89.0485 2.85 . . 2 8 THR N 43.6665 1.96 . . 3 9 GLU N 40.8411 2.03 . . 4 10 TYR N 38.8765 1.76 . . 5 11 LYS N 38.4067 3.66 . . 6 12 LEU N 33.7987 2.9 . . 7 15 VAL N 28.5434 4.22 . . 8 16 GLY N 38.5998 4.67 . . 9 18 GLY N 37.1884 3.65 . . 10 19 GLY N 32.2261 5.45 . . 11 20 VAL N 26.8534 2.63 . . 12 21 GLY N 36.831 6.01 . . 13 22 LYS N 25.1434 8.95 . . 14 23 SER N 33.3573 3.04 . . 15 24 ALA N 30.5656 1.75 . . 16 25 LEU N 29.5944 1.62 . . 17 26 THR N 29.3962 1.52 . . 18 27 ILE N 30.9209 2.23 . . 19 28 GLN N 27.9652 1.38 . . 20 29 LEU N 39.4246 3.98 . . 21 30 ILE N 26.2958 3.31 . . 22 31 GLN N 26.1811 2.62 . . 23 32 ASN N 32.6317 1.97 . . 24 33 HIS N 31.8224 1.06 . . 25 34 PHE N 38.5143 2.15 . . 26 35 VAL N 22.8872 14.4 . . 27 36 ASP N 24.9183 3.3 . . 28 41 THR N 10.2755 4.61 . . 29 43 GLU N 32.2948 3.32 . . 30 44 ASP N 30.4167 1.44 . . 31 45 SER N 31.039 1.55 . . 32 46 TYR N 27.4706 3.68 . . 33 48 LYS N 41.3124 2.13 . . 34 49 GLN N 37.2168 1.01 . . 35 50 VAL N 32.4893 1.93 . . 36 51 VAL N 31.5121 1.22 . . 37 52 ILE N 37.703 2.38 . . 38 53 ASP N 29.8316 1.72 . . 39 54 GLY N 36.9228 1.32 . . 40 55 GLU N 35.5309 0.69 . . 41 56 THR N 41.1424 1.04 . . 42 57 CYS N 40.463 3.93 . . 43 59 LEU N 34.059 2.16 . . 44 60 ASP N 34.9054 5.45 . . 45 61 ILE N 35.3251 2.62 . . 46 63 ASP N 34.479 8.13 . . 47 66 GLY N 28.868 4.14 . . 48 67 GLN N 40.7624 2.76 . . 49 68 GLU N 31.318 4.68 . . 50 69 GLU N 31.5267 2.77 . . 51 71 SER N 31.908 0.765 . . 52 72 ALA N 32.7636 0.9 . . 53 73 MET N 36.4676 0.882 . . 54 74 ARG N 34.3943 1.22 . . 55 75 ASP N 31.0653 0.841 . . 56 76 GLN N 33.4369 0.864 . . 57 77 TYR N 31.9839 1 . . 58 78 MET N 32.1143 1 . . 59 80 THR N 34.6606 1.58 . . 60 81 GLY N 34.2931 1.49 . . 61 82 GLU N 24.9332 5.54 . . 62 83 GLY N 27.7724 1.52 . . 63 84 PHE N 35.1658 3.81 . . 64 85 LEU N 31.52 0.64 . . 65 86 CYS N 30.6323 2.99 . . 66 87 VAL N 31.7329 3.13 . . 67 88 PHE N 34.4796 4.3 . . 68 89 ALA N 28.3609 2.62 . . 69 90 ILE N 32.1292 2.46 . . 70 91 ASN N 24.8149 1.4 . . 71 92 ASN N 32.1567 0.354 . . 72 94 LYS N 39.5396 3.38 . . 73 95 SER N 32.1471 0.69 . . 74 96 PHE N 26.8509 2.52 . . 75 99 ILE N 27.5528 1.28 . . 76 100 HIS N 30.203 0.928 . . 77 101 GLN N 32.8645 0.553 . . 78 102 TYR N 32.1731 0.708 . . 79 104 GLU N 27.569 0.914 . . 80 105 GLN N 33.9115 1.05 . . 81 108 ARG N 29.3467 1.45 . . 82 109 VAL N 31.1844 0.649 . . 83 111 ASP N 33.0739 0.411 . . 84 112 SER N 37.3728 1.47 . . 85 114 ASP N 47.3156 0.866 . . 86 115 VAL N 53.4291 1.27 . . 87 117 MET N 29.5996 2.49 . . 88 118 VAL N 28.8461 2.05 . . 89 119 LEU N 31.8763 3.83 . . 90 120 VAL N 28.6307 2.4 . . 91 121 GLY N 31.822 2.03 . . 92 122 ASN N 34.8722 3.57 . . 93 124 CYS N 29.9642 2.41 . . 94 125 ASP N 25.6394 1.6 . . 95 126 LEU N 30.0456 1.63 . . 96 127 ALA N 34.075 0.871 . . 97 128 ALA N 42.2413 0.311 . . 98 129 ARG N 45.9063 1.81 . . 99 130 THR N 31.5157 5.03 . . 100 131 VAL N 30.7778 1.95 . . 101 132 GLU N 36.617 1.42 . . 102 133 SER N 34.2613 2.08 . . 103 134 ARG N 27.7813 0.975 . . 104 135 GLN N 33.847 0.773 . . 105 136 ALA N 32.8371 1.11 . . 106 139 LEU N 33.5278 2.16 . . 107 140 ALA N 41.2454 1.56 . . 108 141 ARG N 32.5904 0.996 . . 109 142 SER N 31.2662 0.355 . . 110 143 TYR N 32.6704 1.62 . . 111 144 GLY N 30.3905 0.958 . . 112 145 ILE N 34.2961 2.34 . . 113 148 ILE N 31.7244 1.42 . . 114 149 GLU N 27.7933 1.19 . . 115 150 THR N 34.1111 3.04 . . 116 151 SER N 35.2664 1.9 . . 117 152 ALA N 28.058 2.41 . . 118 153 LYS N 33.2681 1.53 . . 119 154 THR N 31.5606 2.85 . . 120 155 ARG N 30.5558 1.38 . . 121 156 GLN N 41.8546 2.67 . . 122 157 GLY N 32.1334 2.51 . . 123 158 VAL N 30.1987 0.9 . . 124 159 GLU N 27.6579 1.96 . . 125 161 ALA N 37.043 2.89 . . 126 162 PHE N 34.7596 1.58 . . 127 163 TYR N 30.6879 1.17 . . 128 164 THR N 29.9186 1.78 . . 129 165 LEU N 31.4609 1.14 . . 130 166 VAL N 29.0364 2.26 . . 131 167 ARG N 29.5865 1.94 . . 132 168 GLU N 29.2626 0.733 . . 133 170 ARG N 31.868 1.25 . . 134 171 GLN N 33.1955 0.595 . . 135 172 HIS N 43.6571 1.75 . . stop_ save_ save_heteronuclear_noe_list_1 _Saveframe_category heteronuclear_NOE _Details . loop_ _Experiment_label '2D 1H-15N HSQC' stop_ loop_ _Sample_label . stop_ _Sample_conditions_label $sample_conditions_1 _Spectrometer_frequency_1H 749.93 _Mol_system_component_name H-Ras-GppNHp _Atom_one_atom_name N _Atom_two_atom_name H _Heteronuclear_NOE_value_type 'peak height' _NOE_reference_value 0.288563 _NOE_reference_description . _Text_data_format . _Text_data . loop_ _Residue_seq_code _Residue_label _Heteronuclear_NOE_value _Heteronuclear_NOE_value_error 7 MET 0.202651 0.00499901 8 THR 0.460327 0.0164323 9 GLU 0.761654 0.0287314 10 TYR 0.62459 0.0329856 11 LYS 0.881093 0.071993 12 LEU 0.960945 0.0816211 15 VAL 0.916353 0.073344 16 GLY 0.820072 0.06473 18 GLY 0.933248 0.059757 19 GLY 0.901682 0.117373 20 VAL 0.950598 0.046546 21 GLY 1.0104 0.0842001 22 LYS 0.86991 0.117565 23 SER 0.956419 0.0642027 24 ALA 0.817588 0.0527197 25 LEU 0.886563 0.0468208 26 THR 0.896213 0.0484715 27 ILE 0.821124 0.0730046 28 GLN 0.788183 0.0437373 29 LEU 0.930233 0.051621 30 ILE 0.831425 0.0759774 31 GLN 1.09131 0.0880555 32 ASN 0.903438 0.0464246 33 HIS 0.80292 0.0355364 34 PHE 0.89386 0.050294 35 VAL 0.643416 0.141238 36 ASP 0.81824 0.0898071 41 THR 0.77864 0.157309 43 GLU 1.06608 0.0993643 44 ASP 1.07436 0.0817966 45 SER 0.91682 0.0978418 46 TYR 0.918273 0.0910128 48 LYS 0.774438 0.0429746 49 GLN 0.84416 0.0511126 50 VAL 0.930911 0.0516586 51 VAL 0.776435 0.0399487 52 ILE 0.915177 0.0692625 53 ASP 0.714904 0.0578438 54 GLY 0.771802 0.0358011 55 GLU 0.82464 0.0241418 56 THR 1.01206 0.0502483 57 CYS 0.855916 0.0380489 59 LEU 0.795428 0.0665154 60 ASP 0.928498 0.0690239 61 ILE 0.917054 0.0681731 63 ASP 0.919091 0.119639 66 GLY 0.678884 0.0644342 67 GLN 0.632537 0.0296267 68 GLU 0.834269 0.0875752 69 GLU 0.774674 0.046651 72 ALA 0.654129 0.0278461 73 MET 0.768054 0.0231262 74 ARG 0.739173 0.0234954 75 ASP 0.714017 0.0237643 76 GLN 0.633907 0.0220418 77 TYR 0.685523 0.0252386 78 MET 0.94257 0.0544869 80 THR 0.816067 0.0367628 81 GLY 0.806488 0.0331532 82 GLU 0.90273 0.107503 83 GLY 0.922655 0.0468339 84 PHE 0.775107 0.0813649 85 LEU 0.904358 0.0784807 86 CYS 0.756919 0.0455818 87 VAL 0.780369 0.0669775 88 PHE 0.897893 0.0584397 89 ALA 0.985615 0.0761694 90 ILE 0.791055 0.0624397 91 ASN 0.879268 0.0374303 92 ASN 0.817552 0.0290135 94 LYS 0.906502 0.0362778 95 SER 0.890437 0.044127 96 PHE 1.08869 0.0774445 99 ILE 0.883059 0.0375917 100 HIS 0.867337 0.0263833 101 GLN 0.728629 0.0242506 102 TYR 0.816738 0.0351948 104 GLU 0.934057 0.044176 105 GLN 0.815045 0.0312895 108 ARG 0.861181 0.0292204 109 VAL 0.756151 0.0184455 111 ASP 0.753229 0.0295896 112 SER 0.6815 0.0184204 113 ASP 0.327499 0.0119318 114 ASP 0.432271 0.0167171 115 VAL 0.294992 0.0126948 117 MET 0.90235 0.0515376 118 VAL 0.749691 0.047156 119 LEU 1.10113 0.0888484 120 VAL 0.728908 0.0606371 121 GLY 0.736792 0.052099 122 ASN 0.915157 0.0595634 124 CYS 0.809756 0.0499313 125 ASP 0.909662 0.043531 126 LEU 0.875295 0.0384277 127 ALA 0.700183 0.033062 128 ALA 0.635345 0.0213579 129 ARG 0.646194 0.0236413 130 THR 1.02642 0.213837 131 VAL 0.726176 0.0456769 132 GLU 0.773811 0.0429398 133 SER 0.86414 0.0410087 134 ARG 0.752503 0.0280053 135 GLN 0.860312 0.0345283 136 ALA 0.761049 0.0287086 139 LEU 0.858251 0.0401986 140 ALA 0.76575 0.0193474 141 ARG 0.853234 0.0263996 142 SER 0.869606 0.0223785 143 TYR 0.860393 0.0437906 144 GLY 0.902204 0.0417416 145 ILE 0.887491 0.0445506 148 ILE 0.922276 0.054076 149 GLU 0.804692 0.0407209 150 THR 0.903332 0.0529653 151 SER 0.874958 0.0520979 152 ALA 0.847783 0.0692714 153 LYS 0.750164 0.0493838 154 THR 1.03692 0.0789466 156 GLN 0.627628 0.0275545 157 GLY 0.839396 0.0541259 158 VAL 0.916006 0.0405602 159 GLU 0.825819 0.0397432 161 ALA 0.857468 0.0257383 162 PHE 0.938285 0.0459431 163 TYR 0.89887 0.0430146 164 THR 0.942903 0.0461692 165 LEU 0.852696 0.0399384 166 VAL 0.933112 0.0517808 167 ARG 0.840151 0.0518056 168 GLU 1.1002 0.0661137 170 ARG 0.651697 0.0349465 171 GLN 0.770493 0.0194672 172 HIS 0.608627 0.0115707 stop_ save_