data_AVS_bmrb_pdb_report_15807 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 15807 _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 41 ARG Anomalous Consistent Consistent Anomalous Consistent Consistent . . 15807 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 41 ARG CA 57.284 . 56.95 2.41 8.8977e-01 15807 1 1 1 1 41 ARG CB 28.820 . 30.66 1.77 2.9855e-01 15807 1 1 1 1 41 ARG CG 26.996 . 27.31 1.65 8.4907e-01 15807 1 1 1 1 41 ARG CD 43.433 . 43.1 1.1 7.6210e-01 15807 1 1 1 1 41 ARG H 8.842 . 8.24 0.6 3.1570e-01 15807 1 1 1 1 41 ARG HA 2.952 . 4.27 0.44 2.7404e-03 15807 1 1 1 1 41 ARG HB2 1.018 . 1.79 0.28 5.8309e-03 15807 1 1 1 1 41 ARG HB3 -0.289 A 1.78 0.28 1.4762e-13 15807 1 1 1 1 41 ARG HG2 0.725 . 1.58 0.27 1.5420e-03 15807 1 1 1 1 41 ARG HG3 0.034 S 1.58 0.27 1.0287e-08 15807 1 1 1 1 41 ARG HD2 2.765 . 3.13 0.23 1.1252e-01 15807 1 1 1 1 41 ARG HD3 2.690 . 3.13 0.22 4.5500e-02 15807 1 1 1 1 41 ARG N 132.909 . 120.61 3.9 1.6128e-03 15807 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 41 ARG ARG 0.56 15807 1 1 1 1 41 ARG LEU 0.16 15807 1 1 1 1 41 ARG LYS 0.15 15807 1 1 1 1 41 ARG GLY 0.11 15807 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 15807 _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 15807 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 15807 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 15807 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 15807 _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_