data_AVS_bmrb_pdb_report_15717 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 15717 _AVS_report.ID 1 _AVS_report.Software_ID 1 _AVS_report.Software_label $AVS loop_ _AVS_analysis.Assembly_ID _AVS_analysis.Entity_assembly_ID _AVS_analysis.Entity_ID _AVS_analysis.Comp_index_ID _AVS_analysis.Comp_ID _AVS_analysis.Comp_overall_assignment_score _AVS_analysis.Comp_typing_score _AVS_analysis.Comp_SRO_score _AVS_analysis.Comp_1H_shifts_analysis_status _AVS_analysis.Comp_13C_shifts_analysis_status _AVS_analysis.Comp_15N_shifts_analysis_status _AVS_analysis.SRO_rule_break _AVS_analysis.SRO_rule_break_probability _AVS_analysis.Entry_ID _AVS_analysis.AVS_report_ID 1 1 1 8 CYC13 UNSUPPORTED . . . . . . . 15717 1 1 1 1 144 LYS Anomalous Consistent Consistent Consistent Anomalous Consistent . . 15717 1 stop_ loop_ _AVS_analysis.Assembly_ID _AVS_analysis.Entity_assembly_ID _AVS_analysis.Entity_ID _AVS_analysis.Comp_index_ID _AVS_analysis.Comp_ID _AVS_analysis.Atom_ID _AVS_analysis.Observed_chem_shift _AVS_analysis.Observed_chem_shift_typing _AVS_analysis.Stat_chem_shift_expected _AVS_analysis.Stat_chem_shift_std _AVS_analysis.Stat_chem_shift_chi_sqr _AVS_analysis.Entry_ID _AVS_analysis.AVS_report_ID 1 1 1 144 LYS C 181.884 A 176.46 2.05 8.1485e-03 15717 1 1 1 1 144 LYS CA 60.195 . 56.84 2.25 1.3593e-01 15717 1 1 1 1 144 LYS CB 32.310 . 32.83 1.88 7.8209e-01 15717 1 1 1 1 144 LYS CG 25.534 . 24.91 1.31 6.3383e-01 15717 1 1 1 1 144 LYS CD 29.372 . 28.78 1.39 6.7018e-01 15717 1 1 1 1 144 LYS H 8.665 . 8.22 0.64 4.8686e-01 15717 1 1 1 1 144 LYS HA 3.903 . 4.28 0.45 4.0216e-01 15717 1 1 1 1 144 LYS HB2 1.718 . 1.79 0.25 7.7335e-01 15717 1 1 1 1 144 LYS HG2 1.283 . 1.38 0.27 7.1940e-01 15717 1 1 1 1 144 LYS HG3 1.43 . 1.37 0.29 8.3609e-01 15717 1 1 1 1 144 LYS HD2 1.523 . 1.61 0.25 7.2784e-01 15717 1 1 1 1 144 LYS HE2 2.795 . 2.93 0.2 4.9968e-01 15717 1 1 1 1 144 LYS N 121.247 . 121.16 4.11 9.8311e-01 15717 1 stop_ loop_ _AVS_analysis.Assembly_ID _AVS_analysis.Entity_assembly_ID _AVS_analysis.Entity_ID _AVS_analysis.Comp_index_ID _AVS_analysis.Comp_ID _AVS_analysis.PRTL_comp_type _AVS_analysis.PRTL_probability_score _AVS_analysis.Entry_ID _AVS_analysis.AVS_report_ID 1 1 1 144 LYS CYS 0.52 15717 1 1 1 1 144 LYS LYS 0.45 15717 1 1 1 1 144 LYS MET 0.01 15717 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 15717 _Software.ID 1 _Software.Name "AutoPeak - validate_assignments" _Software.Version 1.4 _Software.Details ; Original version modified by BMRB to export results in a BMRB STAR format. Changed status "Misassigned" to "Anomalous" ; loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Hunter Moseley" ; Center for Advanced Biotechnology and Medicine Rutgers University 679 Hoes Lane, Piscataway NJ 08854-5638 ; hunter@cabm.rutgers.edu 15717 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 15717 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 15717 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 15717 _Citation.ID 2 _Citation.Class citation _Citation.PubMed_ID 14872126 _Citation.Full_citation ; Moseley HN, Sahota G, Montelione GT., Assignment validation software suite for the evaluation and presentation of protein resonance assignment data. J Biomol NMR. 28, 341-55 (2004) ; _Citation.Status published _Citation.Type journal save_