data_AVS_bmrb_pdb_report_10287 save_AVS_chem_shift_analysis _AVS_report.Sf_category AVS_report _AVS_report.Sf_framecode AVS_chem_shift_analysis _AVS_report.Entry_ID 10287 _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 58 ARG Anomalous Consistent Consistent Anomalous Consistent Consistent . . 10287 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 58 ARG C 179.186 . 176.49 2.16 2.1198e-01 10287 1 1 1 1 58 ARG CA 56.770 . 56.95 2.41 9.4046e-01 10287 1 1 1 1 58 ARG CB 28.145 . 30.66 1.77 1.5534e-01 10287 1 1 1 1 58 ARG CG 24.131 . 27.31 1.65 5.4021e-02 10287 1 1 1 1 58 ARG CD 41.023 . 43.1 1.1 5.9002e-02 10287 1 1 1 1 58 ARG H 8.048 . 8.24 0.6 7.4897e-01 10287 1 1 1 1 58 ARG HA 3.489 . 4.27 0.44 7.5898e-02 10287 1 1 1 1 58 ARG HB2 0.835 S 1.79 0.28 6.4793e-04 10287 1 1 1 1 58 ARG HB3 -0.140 A 1.78 0.28 7.0251e-12 10287 1 1 1 1 58 ARG HG2 -0.179 S 1.58 0.27 7.2779e-11 10287 1 1 1 1 58 ARG HG3 -0.280 A 1.58 0.27 5.6230e-12 10287 1 1 1 1 58 ARG HD2 2.053 S 3.13 0.23 2.8325e-06 10287 1 1 1 1 58 ARG HD3 2.464 . 3.13 0.22 2.4677e-03 10287 1 1 1 1 58 ARG HE 8.427 . 7.32 0.52 3.3267e-02 10287 1 1 1 1 58 ARG N 122.160 . 120.61 3.9 6.9105e-01 10287 1 1 1 1 58 ARG NE 86.529 . 89.8 12.83 7.9876e-01 10287 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 58 ARG LYS 0.52 10287 1 1 1 1 58 ARG LEU 0.43 10287 1 1 1 1 58 ARG ARG 0.03 10287 1 stop_ save_ save_AVS _Software.Sf_category software _Software.Sf_framecode AVS _Software.Entry_ID 10287 _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 10287 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID "validate protein chemical shift assignments" 10287 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 2 $AVS_citation 10287 1 stop_ save_ save_AVS_citation _Citation.Sf_category citation _Citation.Sf_framecode AVS_citation _Citation.Entry_ID 10287 _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_