data_16753 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR Study on the Structural Changes of Cytochrome P450cam upon the Complex Formation with Putidaredoxin ; _BMRB_accession_number 16753 _BMRB_flat_file_name bmr16753.str _Entry_type original _Submission_date 2010-03-03 _Accession_date 2010-03-03 _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 Tosha Takehiko . . 2 Yoshioka Shiro . . 3 Takahashi Satoshi . . 4 Ishimori Koichiro . . 5 Shimada Hideo . . 6 Morishima Isao . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count binding_constants 1 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2010-03-24 original author . stop_ _Original_release_date 2010-03-24 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'NMR Study on the Structural Changes of Cytochrome P450cam on the Complex Formation with Putidaredoxin' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 12842870 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Tosha Takehiko . . 2 Yoshioka Shiro . . 3 Takahashi Satoshi . . 4 Ishimori Koichiro . . 5 Shimada Hideo . . 6 Morishima Isao . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_volume 278 _Journal_issue 41 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 39809 _Page_last 39821 _Year 2003 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'P450cam Pdx complex' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label P450cam $P450cam Pdx $Pdx 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_P450cam _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common P450cam _Molecular_mass . _Mol_thiol_state 'not reported' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 414 _Mol_residue_sequence ; TTETIQSNANLAPLPPHVPE HLVFDFDMYNPSNLSAGVQE AWAVLQESNVPDLVWTRCNG GHWIATRGQLIREAYEDYRH FSSECPFIPREAGEAYDFIP TSMDPPEQRQFRALANQVVG MPVVDKLENRIQELACSLIE SLRPQGQCNFTEDYAEPFPI RIFMLLAGLPEEDIPHLKYL TDQMTRPDGSMTFAEAKEAL YDYLIPIIEQRRQKPGTDAI SIVANGQVNGRPITSDEAKR MCGLLLVGGLDTVVNFLSFS MEFLAKSPEHRQELIQRPER IPAACEELLRRFSLVADGRI LTSDYEFHGVQLKKGDQILL PQMLSGLDERENACPMHVDF SRQKVSHTTFGHGSHLCLGQ HLARREIIVTLKEWLTRIPD FSIAPGAQIQHKSGIVSGVQ ALPLVWDPATTKAV ; loop_ _Residue_seq_code _Residue_label 1 THR 2 THR 3 GLU 4 THR 5 ILE 6 GLN 7 SER 8 ASN 9 ALA 10 ASN 11 LEU 12 ALA 13 PRO 14 LEU 15 PRO 16 PRO 17 HIS 18 VAL 19 PRO 20 GLU 21 HIS 22 LEU 23 VAL 24 PHE 25 ASP 26 PHE 27 ASP 28 MET 29 TYR 30 ASN 31 PRO 32 SER 33 ASN 34 LEU 35 SER 36 ALA 37 GLY 38 VAL 39 GLN 40 GLU 41 ALA 42 TRP 43 ALA 44 VAL 45 LEU 46 GLN 47 GLU 48 SER 49 ASN 50 VAL 51 PRO 52 ASP 53 LEU 54 VAL 55 TRP 56 THR 57 ARG 58 CYS 59 ASN 60 GLY 61 GLY 62 HIS 63 TRP 64 ILE 65 ALA 66 THR 67 ARG 68 GLY 69 GLN 70 LEU 71 ILE 72 ARG 73 GLU 74 ALA 75 TYR 76 GLU 77 ASP 78 TYR 79 ARG 80 HIS 81 PHE 82 SER 83 SER 84 GLU 85 CYS 86 PRO 87 PHE 88 ILE 89 PRO 90 ARG 91 GLU 92 ALA 93 GLY 94 GLU 95 ALA 96 TYR 97 ASP 98 PHE 99 ILE 100 PRO 101 THR 102 SER 103 MET 104 ASP 105 PRO 106 PRO 107 GLU 108 GLN 109 ARG 110 GLN 111 PHE 112 ARG 113 ALA 114 LEU 115 ALA 116 ASN 117 GLN 118 VAL 119 VAL 120 GLY 121 MET 122 PRO 123 VAL 124 VAL 125 ASP 126 LYS 127 LEU 128 GLU 129 ASN 130 ARG 131 ILE 132 GLN 133 GLU 134 LEU 135 ALA 136 CYS 137 SER 138 LEU 139 ILE 140 GLU 141 SER 142 LEU 143 ARG 144 PRO 145 GLN 146 GLY 147 GLN 148 CYS 149 ASN 150 PHE 151 THR 152 GLU 153 ASP 154 TYR 155 ALA 156 GLU 157 PRO 158 PHE 159 PRO 160 ILE 161 ARG 162 ILE 163 PHE 164 MET 165 LEU 166 LEU 167 ALA 168 GLY 169 LEU 170 PRO 171 GLU 172 GLU 173 ASP 174 ILE 175 PRO 176 HIS 177 LEU 178 LYS 179 TYR 180 LEU 181 THR 182 ASP 183 GLN 184 MET 185 THR 186 ARG 187 PRO 188 ASP 189 GLY 190 SER 191 MET 192 THR 193 PHE 194 ALA 195 GLU 196 ALA 197 LYS 198 GLU 199 ALA 200 LEU 201 TYR 202 ASP 203 TYR 204 LEU 205 ILE 206 PRO 207 ILE 208 ILE 209 GLU 210 GLN 211 ARG 212 ARG 213 GLN 214 LYS 215 PRO 216 GLY 217 THR 218 ASP 219 ALA 220 ILE 221 SER 222 ILE 223 VAL 224 ALA 225 ASN 226 GLY 227 GLN 228 VAL 229 ASN 230 GLY 231 ARG 232 PRO 233 ILE 234 THR 235 SER 236 ASP 237 GLU 238 ALA 239 LYS 240 ARG 241 MET 242 CYS 243 GLY 244 LEU 245 LEU 246 LEU 247 VAL 248 GLY 249 GLY 250 LEU 251 ASP 252 THR 253 VAL 254 VAL 255 ASN 256 PHE 257 LEU 258 SER 259 PHE 260 SER 261 MET 262 GLU 263 PHE 264 LEU 265 ALA 266 LYS 267 SER 268 PRO 269 GLU 270 HIS 271 ARG 272 GLN 273 GLU 274 LEU 275 ILE 276 GLN 277 ARG 278 PRO 279 GLU 280 ARG 281 ILE 282 PRO 283 ALA 284 ALA 285 CYS 286 GLU 287 GLU 288 LEU 289 LEU 290 ARG 291 ARG 292 PHE 293 SER 294 LEU 295 VAL 296 ALA 297 ASP 298 GLY 299 ARG 300 ILE 301 LEU 302 THR 303 SER 304 ASP 305 TYR 306 GLU 307 PHE 308 HIS 309 GLY 310 VAL 311 GLN 312 LEU 313 LYS 314 LYS 315 GLY 316 ASP 317 GLN 318 ILE 319 LEU 320 LEU 321 PRO 322 GLN 323 MET 324 LEU 325 SER 326 GLY 327 LEU 328 ASP 329 GLU 330 ARG 331 GLU 332 ASN 333 ALA 334 CYS 335 PRO 336 MET 337 HIS 338 VAL 339 ASP 340 PHE 341 SER 342 ARG 343 GLN 344 LYS 345 VAL 346 SER 347 HIS 348 THR 349 THR 350 PHE 351 GLY 352 HIS 353 GLY 354 SER 355 HIS 356 LEU 357 CYS 358 LEU 359 GLY 360 GLN 361 HIS 362 LEU 363 ALA 364 ARG 365 ARG 366 GLU 367 ILE 368 ILE 369 VAL 370 THR 371 LEU 372 LYS 373 GLU 374 TRP 375 LEU 376 THR 377 ARG 378 ILE 379 PRO 380 ASP 381 PHE 382 SER 383 ILE 384 ALA 385 PRO 386 GLY 387 ALA 388 GLN 389 ILE 390 GLN 391 HIS 392 LYS 393 SER 394 GLY 395 ILE 396 VAL 397 SER 398 GLY 399 VAL 400 GLN 401 ALA 402 LEU 403 PRO 404 LEU 405 VAL 406 TRP 407 ASP 408 PRO 409 ALA 410 THR 411 THR 412 LYS 413 ALA 414 VAL stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-18 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 17415 entity_1 99.76 413 99.76 100.00 0.00e+00 BMRB 19038 entity_1 97.58 404 100.00 100.00 0.00e+00 BMRB 19740 CYP101 100.00 414 99.52 99.76 0.00e+00 BMRB 19763 CYP101 100.00 414 99.52 99.76 0.00e+00 PDB 1AKD "Cytochrome P450cam From Pseudomonas Putida, Complexed With 1s-Camphor" 100.00 414 100.00 100.00 0.00e+00 PDB 1C8J "Crystal Structure Of Cytochrome P450cam Mutant (F87wY96F)" 100.00 414 99.28 100.00 0.00e+00 PDB 1CP4 "Formation, Crystal Structure, And Rearrangement Of A Cytochrome P450-Cam Iron-Phenyl Complex" 100.00 414 99.76 100.00 0.00e+00 PDB 1DZ4 "Ferric P450cam From Pseudomonas Putida" 100.00 414 100.00 100.00 0.00e+00 PDB 1DZ6 "Ferrous P450cam From Pseudomonas Putida" 100.00 414 100.00 100.00 0.00e+00 PDB 1DZ8 "Oxygen Complex Of P450cam From Pseudomonas Putida" 100.00 414 100.00 100.00 0.00e+00 PDB 1DZ9 "Putative Oxo Complex Of P450cam From Pseudomonas Putida" 100.00 414 100.00 100.00 0.00e+00 PDB 1GEB "X-Ray Crystal Structure And Catalytic Properties Of Thr252ile Mutant Of Cytochrome P450cam" 100.00 415 99.52 99.76 0.00e+00 PDB 1GEK "Structural Characterization Of N-Butyl-Isocyanide Complexes Of Cytochromes P450nor And P450cam" 100.00 415 99.76 100.00 0.00e+00 PDB 1GEM "Structural Characterization Of N-Butyl-Isocyanide Complexes Of Cytochromes P450nor And P450cam" 100.00 415 99.76 100.00 0.00e+00 PDB 1GJM "Covalent Attachment Of An Electroactive Sulphydryl Reagent In The Active Site Of Cytochrome P450cam" 100.00 414 99.52 99.76 0.00e+00 PDB 1IWI "Putidaredoxin-Binding Stablilizes An Active Conformer Of Cytochrome P450cam In Its Reduced State; Crystal Structure Of Cytochro" 100.00 415 99.76 100.00 0.00e+00 PDB 1IWJ "Putidaredoxin-Binding Stablilizes An Active Conformer Of Cytochrome P450cam In Its Reduced State; Crystal Structure Of Mutant(1" 100.00 415 99.52 100.00 0.00e+00 PDB 1IWK "Putidaredoxin-Binding Stablilizes An Active Conformer Of Cytochrome P450cam In Its Reduced State; Crystal Structure Of Mutant(1" 100.00 415 99.52 100.00 0.00e+00 PDB 1J51 "Crystal Structure Of Cytochrome P450cam Mutant (F87wY96FV247LC334A) WITH 1,3,5-Trichlorobenzene" 100.00 414 98.79 99.76 0.00e+00 PDB 1K2O "Cytochrome P450cam With Bound Bis(2,2'-Bipyridine)-(5-Methyl-2-2'- Bipyridine)-C2-Adamantane Ruthenium (Ii)" 100.00 414 99.52 99.76 0.00e+00 PDB 1LWL "Crystal Structure Of Cytochrome P450-Cam With A Fluorescent Probe D-8-Ad (Adamantane-1-Carboxylic Acid-5-Dimethylamino- Naphtha" 100.00 417 99.76 100.00 0.00e+00 PDB 1MPW "Molecular Recognition In (+)-a-pinene Oxidation By Cytochrome P450cam" 100.00 414 98.79 99.76 0.00e+00 PDB 1NOO "Cytochrome P450-Cam Complexed With 5-Exo-Hydroxycamphor" 100.00 414 99.76 100.00 0.00e+00 PDB 1O76 "Cyanide Complex Of P450cam From Pseudomonas Putida" 100.00 414 100.00 100.00 0.00e+00 PDB 1P2Y "Crystal Structure Of Cytochrome P450cam In Complex With (S)- (-)-Nicotine" 100.00 420 99.76 100.00 0.00e+00 PDB 1P7R "Crystal Structure Of Reduced, Co-Exposed Complex Of Cytochrome P450cam With (S)-(-)-Nicotine" 100.00 420 99.76 100.00 0.00e+00 PDB 1PHA "Inhibitor-Induced Conformational Change In Cytochrome P450- Cam" 100.00 414 99.76 100.00 0.00e+00 PDB 1PHB "Inhibitor-Induced Conformational Change In Cytochrome P450- Cam" 100.00 414 99.76 100.00 0.00e+00 PDB 1PHC "Crystal Structure Of Substrate-free Pseudomonas Putida Cytochrome P450" 100.00 414 99.76 100.00 0.00e+00 PDB 1PHD "Crystal Structures Of Metyrapone-And Phenylimidazole-Inhibited Complexes Of Cytochrome P450-Cam" 100.00 414 99.76 100.00 0.00e+00 PDB 1PHE "Crystal Structures Of Metyrapone-And Phenylimidazole-Inhibited Complexes Of Cytochrome P450-Cam" 100.00 414 99.76 100.00 0.00e+00 PDB 1PHF "Crystal Structures Of Metyrapone-And Phenylimidazole- Inhibited Complexes Of Cytochrome P450-Cam" 100.00 414 99.76 100.00 0.00e+00 PDB 1PHG "Crystal Structures Of Metyrapone-And Phenylimidazole- Inhibited Complexes Of Cytochrome P450-Cam" 100.00 414 99.76 100.00 0.00e+00 PDB 1QMQ "Optical Detection Of Cytochrome P450 By Sensitizer-Linked Substrates" 100.00 414 99.52 99.76 0.00e+00 PDB 1RE9 "Crystal Structure Of Cytochrome P450-cam With A Fluorescent Probe D-8-ad (adamantane-1-carboxylic Acid-5-dimethylamino- Naphtha" 100.00 414 99.76 100.00 0.00e+00 PDB 1RF9 "Crystal Structure Of Cytochrome P450-Cam With A Fluorescent Probe D-4-Ad (Adamantane-1-Carboxylic Acid-5-Dimethylamino- Naphtha" 100.00 417 99.76 100.00 0.00e+00 PDB 1T85 "Crystal Structure Of The Ferrous Co-Bound Cytochrome P450cam Mutant (L358pC334A)" 100.00 414 99.28 99.52 0.00e+00 PDB 1T86 "Crystal Structure Of The Ferrous Cytochrome P450cam Mutant (L358pC334A)" 100.00 414 99.28 99.52 0.00e+00 PDB 1T87 "Crystal Structure Of The Ferrous Co-Bound Cytochrome P450cam (C334a)" 100.00 414 99.52 99.76 0.00e+00 PDB 1T88 "Crystal Structure Of The Ferrous Cytochrome P450cam (C334a)" 100.00 414 99.52 99.76 0.00e+00 PDB 1UYU "Xenon Complex Of Wildtype P450cam From Pseudomonas Putida" 100.00 414 100.00 100.00 0.00e+00 PDB 1YRC "X-ray Crystal Structure Of Hydrogenated Cytochrome P450cam" 100.00 414 99.76 100.00 0.00e+00 PDB 1YRD "X-Ray Crystal Structure Of Perdeuterated Cytochrome P450cam" 100.00 414 99.76 100.00 0.00e+00 PDB 2A1M "Crystal Structure Of Ferrous Dioxygen Complex Of Wild-Type Cytochrome P450cam" 100.00 415 99.52 99.76 0.00e+00 PDB 2A1N "Crystal Structure Of Ferrous Dioxygen Complex Of D251n Cytochrome P450cam" 100.00 415 99.28 99.76 0.00e+00 PDB 2A1O "Crystal Structure Of Ferrous Dioxygen Complex Of T252a Cytochrome P450cam" 100.00 415 99.28 99.52 0.00e+00 PDB 2CP4 "Crystal Structure Of The Cytochrome P450-Cam Active Site Mutant Thr252ala" 100.00 414 99.52 99.76 0.00e+00 PDB 2CPP "High-Resolution Crystal Structure Of Cytochrome P450-Cam" 100.00 414 99.76 100.00 0.00e+00 PDB 2FE6 "P450cam From Pseudomonas Putida Reconstituted With Manganic Protoporphyrin Ix" 100.00 421 99.76 100.00 0.00e+00 PDB 2FER "P450cam From Pseudomonas Putida Reconstituted With Manganic Protoporphyrin Ix" 97.83 411 99.75 100.00 0.00e+00 PDB 2FEU "P450cam From Pseudomonas Putida Reconstituted With Manganic Protoporphyrin Ix" 97.83 411 99.75 100.00 0.00e+00 PDB 2FRZ "Crystal Structure Of Cytochrome P450cam Mutant (F87wY96FV247LC334A)" 100.00 414 98.79 99.76 0.00e+00 PDB 2GQX "Crystal Structure Of Cytochrome P450cam Mutant (F87wY96FL244AV247LC334A) WITH PENTACHLOROBENZENE" 97.83 405 98.52 99.51 0.00e+00 PDB 2GR6 "Crystal Structure Of Cytochrome P450cam Mutant (F87wY96FL244AV247LC334A)" 97.83 405 98.52 99.51 0.00e+00 PDB 2H7Q "Cytochrome P450cam Complexed With Imidazole" 100.00 414 99.76 100.00 0.00e+00 PDB 2H7R "L244a Mutant Of Cytochrome P450cam Complexed With Imidazole" 100.00 414 99.28 99.52 0.00e+00 PDB 2H7S "L244a Mutant Of Cytochrome P450cam" 100.00 414 99.28 99.52 0.00e+00 PDB 2L8M "Reduced And Co-Bound Cytochrome P450cam (Cyp101a1)" 100.00 415 99.76 100.00 0.00e+00 PDB 2LQD "Reduced And Co-Bound Cytochrome P450cam (Cyp101a1)" 97.83 405 99.75 100.00 0.00e+00 PDB 2M56 "The Structure Of The Complex Of Cytochrome P450cam And Its Electron Donor Putidaredoxin Determined By Paramagnetic Nmr Spectros" 97.58 404 100.00 100.00 0.00e+00 PDB 2QBL "Crystal Structure Of Ferric G248t Cytochrome P450cam" 100.00 421 99.52 99.76 0.00e+00 PDB 2QBM "Crystal Structure Of The P450cam G248t Mutant In The Cyanide Bound State" 100.00 421 99.52 99.76 0.00e+00 PDB 2QBN "Crystal Structure Of Ferric G248v Cytochrome P450cam" 100.00 421 99.52 99.76 0.00e+00 PDB 2QBO "Crystal Structure Of The P450cam G248v Mutant In The Cyanide Bound State" 100.00 421 99.52 99.76 0.00e+00 PDB 2Z97 "Crystal Structure Of Ferric Cytochrome P450cam Reconstituted With 7- Methyl-7-Depropionated Hemin" 100.00 415 99.76 100.00 0.00e+00 PDB 2ZAW "Crystal Structure Of Ferric Cytochrome P450cam Reconstituted With 6- Methyl-6-Depropionated Hemin" 100.00 415 99.76 100.00 0.00e+00 PDB 2ZAX "Crystal Structure Of Ferric Cytochrome P450cam" 100.00 415 99.76 100.00 0.00e+00 PDB 2ZUH "Crystal Structure Of Camphor-Soaked Ferric Cytochrome P450cam Mutant (D297a)" 100.00 415 99.52 99.76 0.00e+00 PDB 2ZUI "Crystal Structure Of Camphor-Soaked Ferric Cytochrome P450cam Mutant (D297n)" 100.00 415 99.52 100.00 0.00e+00 PDB 2ZUJ "Crystal Structure Of Camphor-Soaked Ferric Cytochrome P450cam Mutant(D297l)" 100.00 415 99.52 99.76 0.00e+00 PDB 2ZWT "Crystal Structure Of Ferric Cytochrome P450cam" 100.00 415 99.76 100.00 0.00e+00 PDB 2ZWU "Crystal Structure Of Camphor Soaked Ferric Cytochrome P450cam" 100.00 415 99.76 100.00 0.00e+00 PDB 3CP4 "Crystal Structure Of The Cytochrome P450-Cam Active Site Mutant Thr252ala" 100.00 414 99.76 100.00 0.00e+00 PDB 3CPP "Crystal Structure Of The Carbon Monoxy-Substrate-Cytochrome P450-Cam Ternary Complex" 100.00 414 99.76 100.00 0.00e+00 PDB 3FWF "Ferric Camphor Bound Cytochrome P450cam Containing A Selenocysteine As The 5th Heme Ligand, Monoclinic Crystal Form" 97.83 405 99.26 99.51 0.00e+00 PDB 3FWG "Ferric Camphor Bound Cytochrome P450cam, Arg365leu, Glu366gln, Monoclinic Crystal Form" 97.83 405 99.51 99.75 0.00e+00 PDB 3FWI "Ferric Camphor Bound Cytochrome P450cam Containing A Selenocysteine As The 5th Heme Ligand, Tetragonal Crystal Form" 97.83 405 99.01 99.51 0.00e+00 PDB 3FWJ "Ferric Camphor Bound Cytochrome P450cam Containing A Selenocysteine As The 5th Heme Ligand, Orthorombic Crystal Form" 97.83 405 99.01 99.51 0.00e+00 PDB 3L61 "Crystal Structure Of Substrate-Free P450cam At 200 Mm [k+]" 100.00 414 99.52 99.76 0.00e+00 PDB 3L62 "Crystal Structure Of Substrate-Free P450cam At Low [k+]" 100.00 414 99.52 99.76 0.00e+00 PDB 3L63 "Crystal Structure Of Camphor-Bound P450cam At Low [k+]" 100.00 414 99.52 99.76 0.00e+00 PDB 3OIA "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac1-C8gluetg-Bio" 100.00 414 99.52 99.76 0.00e+00 PDB 3OL5 "Crystal Structure Of Cytochrome P450cam Crystallized With A Tethered Substrate Analog 3oh-Adac1-C8-Dans" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6M "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac1-C8-Dans" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6N "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac1-C8-Dans" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6O "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac1-Etg-Dans" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6P "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac1-C6-Bio" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6Q "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac2-Etg-Boc" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6R "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog 3oh-Adac1-Etg-Boc" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6S "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac2-C8-Dans" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6T "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac2-C8-Dans" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6U "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac3-C6-Dans" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6V "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog 3et-Adac1-Etg-Boc" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6W "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac3-Etg-Boc" 100.00 414 99.52 99.76 0.00e+00 PDB 3P6X "Crystal Structure Of Cytochrome P450cam Crystallized In The Presence Of A Tethered Substrate Analog Adac3-C8-Dans" 100.00 414 99.52 99.76 0.00e+00 PDB 3W9C "Crystal Structure Of The Electron Transfer Complex Of Cytochrome P450cam With Putidaredoxin" 100.00 416 99.03 99.28 0.00e+00 PDB 3WRH "Crystal Structure Of P450cam" 100.00 421 99.76 100.00 0.00e+00 PDB 3WRI "Crystal Structure Of P450cam" 100.00 421 99.76 100.00 0.00e+00 PDB 3WRJ "Crystal Structure Of P450cam" 100.00 421 99.76 100.00 0.00e+00 PDB 3WRK "Crystal Structure Of P450cam" 100.00 421 99.76 100.00 0.00e+00 PDB 3WRL "Crystal Structure Of P450cam" 100.00 421 99.76 100.00 0.00e+00 PDB 3WRM "Crystal Structure Of P450cam" 100.00 421 99.76 100.00 0.00e+00 PDB 4CP4 "Crystal Structure Of The Cytochrome P450-Cam Active Site Mutant Thr252ala" 100.00 414 99.76 100.00 0.00e+00 PDB 4CPP "Crystal Structures Of Cytochrome P450-Cam Complexed With Camphane, Thiocamphor, And Adamantane: Factors Controlling P450 Substr" 100.00 414 99.76 100.00 0.00e+00 PDB 4EK1 "Crystal Structure Of Electron-Spin Labeled Cytochrome P450cam" 100.00 414 98.07 98.31 0.00e+00 PDB 4G3R "Crystal Structure Of Nitrosyl Cytochrome P450cam" 100.00 414 99.52 99.76 0.00e+00 PDB 4JWS "Crystal Structure Of Cytochrome P450cam-putidaredoxin Complex" 100.00 415 98.31 98.55 0.00e+00 PDB 4JWU "Crystal Structure Of Cytochrome P450cam-putidaredoxin Complex" 100.00 415 98.31 98.55 0.00e+00 PDB 4JX1 "Crystal Structure Of Reduced Cytochrome P450cam-putidaredoxin Complex Bound To Camphor And 5-exo-hydroxycamphor" 100.00 415 98.31 98.55 0.00e+00 PDB 4KKY "Crystal Structure Of N-(1-pyrene)acetamide Labeled P450cam In Substrate Bound Form" 99.76 413 98.06 98.31 0.00e+00 PDB 4L49 "Structure Of L358a Mutant Of P450cam Bound To Camphor" 100.00 415 99.28 99.52 0.00e+00 PDB 4L4A "Structure Of L358a/k178g Mutant Of P450cam Bound To Camphor" 100.00 415 99.03 99.28 0.00e+00 PDB 4L4B "Structure Of L358a/k178g/d182n Mutant Of P450cam Bound To Camphor" 100.00 415 98.79 99.28 0.00e+00 PDB 4L4C "Structure Of L358p/k178g Mutant Of P450cam Bound To Camphor" 100.00 415 99.03 99.28 0.00e+00 PDB 4L4D "Structure Of Cyanide And Camphor Bound P450cam Mutant L358a" 100.00 415 99.28 99.52 0.00e+00 PDB 4L4E "Structure Of Cyanide And Camphor Bound P450cam Mutant L358a/k178g" 100.00 415 99.03 99.28 0.00e+00 PDB 4L4F "Structure Of Cyanide And Camphor Bound P450cam Mutant L358a/k178g/d182n" 100.00 415 98.79 99.28 0.00e+00 PDB 4L4G "Structure Of Cyanide And Camphor Bound P450cam Mutant L358p/k178g" 100.00 415 99.03 99.28 0.00e+00 PDB 5CP4 "Cryogenic Structure Of P450cam" 100.00 414 99.76 100.00 0.00e+00 PDB 5CPP "The Structural Basis For Substrate-Induced Changes In Redox Potential And Spin Equilibrium In Cytochrome P-450(Cam)" 100.00 414 99.76 100.00 0.00e+00 PDB 6CP4 "P450cam D251n Mutant" 100.00 414 99.52 100.00 0.00e+00 PDB 6CPP "Crystal Structures Of Cytochrome P450-Cam Complexed With Camphane, Thiocamphor, And Adamantane: Factors Controlling P450 Substr" 100.00 414 99.76 100.00 0.00e+00 PDB 7CPP "The Structural Basis For Substrate-Induced Changes In Redox Potential And Spin Equilibrium In Cytochrome P450(Cam)" 100.00 414 99.76 100.00 0.00e+00 PDB 8CPP "Crystal Structures Of Cytochrome P450-Cam Complexed With Camphane, Thiocamphor, And Adamantane: Factors Controlling P450 Substr" 100.00 414 99.76 100.00 0.00e+00 DBJ BAN13286 "cytochrome P-450cam [Pseudomonas putida]" 100.00 415 99.76 100.00 0.00e+00 GB AAA25760 "cytochrome P-450-cam [Pseudomonas putida]" 100.00 415 99.76 100.00 0.00e+00 REF WP_032492633 "camphor 5-monooxygenase [Pseudomonas putida]" 100.00 415 99.76 100.00 0.00e+00 REF YP_009083112 "cytochrome P-450cam [Pseudomonas putida]" 100.00 415 99.76 100.00 0.00e+00 SP P00183 "RecName: Full=Camphor 5-monooxygenase; AltName: Full=Cytochrome P450-cam; Short=Cytochrome P450cam" 100.00 415 99.76 100.00 0.00e+00 stop_ save_ save_Pdx _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Pdx _Molecular_mass . _Mol_thiol_state 'not reported' _Details . _Residue_count 106 _Mol_residue_sequence ; SKVVYVSHDGTRRQLDVADG VSLMQAAVSNGIYDIVGDCG GSASCATCHVYVNEAFTDKV PAANEREIGMLECVTAELKP NSRLCCQIIMTPELDGIVVD VPDRQW ; loop_ _Residue_seq_code _Residue_label 1 SER 2 LYS 3 VAL 4 VAL 5 TYR 6 VAL 7 SER 8 HIS 9 ASP 10 GLY 11 THR 12 ARG 13 ARG 14 GLN 15 LEU 16 ASP 17 VAL 18 ALA 19 ASP 20 GLY 21 VAL 22 SER 23 LEU 24 MET 25 GLN 26 ALA 27 ALA 28 VAL 29 SER 30 ASN 31 GLY 32 ILE 33 TYR 34 ASP 35 ILE 36 VAL 37 GLY 38 ASP 39 CYS 40 GLY 41 GLY 42 SER 43 ALA 44 SER 45 CYS 46 ALA 47 THR 48 CYS 49 HIS 50 VAL 51 TYR 52 VAL 53 ASN 54 GLU 55 ALA 56 PHE 57 THR 58 ASP 59 LYS 60 VAL 61 PRO 62 ALA 63 ALA 64 ASN 65 GLU 66 ARG 67 GLU 68 ILE 69 GLY 70 MET 71 LEU 72 GLU 73 CYS 74 VAL 75 THR 76 ALA 77 GLU 78 LEU 79 LYS 80 PRO 81 ASN 82 SER 83 ARG 84 LEU 85 CYS 86 CYS 87 GLN 88 ILE 89 ILE 90 MET 91 THR 92 PRO 93 GLU 94 LEU 95 ASP 96 GLY 97 ILE 98 VAL 99 VAL 100 ASP 101 VAL 102 PRO 103 ASP 104 ARG 105 GLN 106 TRP stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2014-10-19 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 1551 "P450 reductase" 100.00 106 100.00 100.00 4.01e-71 BMRB 19038 entity_2 100.00 106 98.11 99.06 1.26e-69 BMRB 2278 putidaredoxin 100.00 106 100.00 100.00 4.01e-71 BMRB 4149 Pdx-protein 100.00 106 98.11 99.06 1.26e-69 BMRB 4154 Pdxo 100.00 106 99.06 100.00 1.39e-70 PDB 1GPX "C85s Gapdx, Nmr, 20 Structures" 100.00 106 98.11 99.06 1.26e-69 PDB 1OQQ "Crystal Structure Of C73sC85S MUTANT OF PUTIDAREDOXIN, A [2FE-2s] Ferredoxin From Pseudomonas Putida, At 1.47a Resolution" 100.00 106 97.17 98.11 1.18e-68 PDB 1OQR "Crystal Structure Of C73s Mutant Of Putidaredoxin, A [2fe- 2s] Ferredoxin From Pseudomonas Putida, At 1.65a Resolution" 100.00 106 98.11 99.06 1.26e-69 PDB 1PDX Putidaredoxin 100.00 106 99.06 100.00 1.39e-70 PDB 1PUT "An Nmr-Derived Model For The Solution Structure Of Oxidized Putidaredoxin, A 2fe, 2-S Ferredoxin From Pseudomonas" 100.00 106 100.00 100.00 4.01e-71 PDB 1R7S "Putidaredoxin (Fe2s2 Ferredoxin), C73g Mutant" 100.00 106 98.11 99.06 3.88e-69 PDB 1XLN "Crystal Structure Of Oxidized C73sC85S PUTIDAREDOXIN, A [2fe-2s] Ferredoxin From Pseudomonas Putida" 100.00 106 97.17 98.11 1.18e-68 PDB 1XLO "Structure Of Reduced C73s/c85s Putidaredoxin, A [2fe-2s] Ferredoxin From Pseudomonas Putida" 100.00 106 97.17 98.11 1.18e-68 PDB 1XLP "Structure Of Oxidized C73s Putidaredoxin From Pseudomonas Putida" 100.00 106 98.11 99.06 1.26e-69 PDB 1XLQ "Crystal Structure Of Reduced C73s Putidaredoxin From Pseudomonas Putida" 100.00 106 98.11 99.06 1.26e-69 PDB 1YJI "Rdc-Refined Solution Nmr Structure Of Reduced Putidaredoxin" 100.00 106 99.06 100.00 1.39e-70 PDB 1YJJ "Rdc-Refined Solution Nmr Structure Of Oxidized Putidaredoxin" 100.00 106 99.06 100.00 1.39e-70 PDB 2M56 "The Structure Of The Complex Of Cytochrome P450cam And Its Electron Donor Putidaredoxin Determined By Paramagnetic Nmr Spectros" 100.00 106 98.11 99.06 1.26e-69 PDB 3LB8 "Crystal Structure Of The Covalent Putidaredoxin Reductase- Putidaredoxin Complex" 100.00 106 97.17 98.11 1.18e-68 PDB 3W9C "Crystal Structure Of The Electron Transfer Complex Of Cytochrome P450cam With Putidaredoxin" 100.00 108 98.11 99.06 1.48e-69 PDB 4JWS "Crystal Structure Of Cytochrome P450cam-putidaredoxin Complex" 100.00 112 99.06 100.00 1.20e-70 PDB 4JWU "Crystal Structure Of Cytochrome P450cam-putidaredoxin Complex" 100.00 113 97.17 98.11 6.07e-68 PDB 4JX1 "Crystal Structure Of Reduced Cytochrome P450cam-putidaredoxin Complex Bound To Camphor And 5-exo-hydroxycamphor" 100.00 113 97.17 98.11 6.07e-68 DBJ BAA00414 "putidaredoxin [Pseudomonas putida]" 100.00 107 99.06 100.00 1.14e-70 DBJ BAN13288 "putidaredoxin [Pseudomonas putida]" 100.00 107 99.06 100.00 1.14e-70 GB AAA25759 "putidaredoxin [Pseudomonas putida]" 100.00 107 99.06 100.00 1.14e-70 REF WP_032492635 "putidaredoxin [Pseudomonas putida]" 100.00 107 99.06 100.00 1.14e-70 REF YP_009083114 "putidaredoxin [Pseudomonas putida]" 100.00 107 99.06 100.00 1.14e-70 SP P00259 "RecName: Full=Putidaredoxin; Short=PDX [Pseudomonas putida]" 100.00 107 99.06 100.00 1.14e-70 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $P450cam 'Pseudomonas putida' 303 Bacteria . Pseudomonas putida 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 $P450cam 'recombinant technology' . Escherichia coli BL21 na 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 _Concentration_min_value _Concentration_max_value _Isotopic_labeling $P450cam 0.2 mM . . 'natural abundance' 'potassium phosphate' 50 mM . . 'natural abundance' 'potassium chloride' 50 mM . . 'natural abundance' d-camphor 1 mM . . 'natural abundance' $Pdx . mM 0.1 0.8 'natural abundance' H2O 90 % . . 'natural abundance' D2O 10 % . . 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_InsightII _Saveframe_category software _Name InsightII _Version . loop_ _Vendor _Address _Electronic_address 'Accelrys Software Inc.' . . stop_ loop_ _Task 'model drawing' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance DRX' _Field_strength 500 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance DRX' _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_1H_NMR_1 _Saveframe_category NMR_applied_experiment _Experiment_name '1H NMR' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 7.0 . pH pressure 1 . atm temperature 313 . K stop_ save_