data_1nao_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1nao _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.501 -2.675 1 C3'-C2'-C1' 106.672 5.747 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 2.228 1 C3'-C2'-C1' 106.209 5.233 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.446 2.675 0 C5'-C4'-C3' 111.531 -2.646 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' G' . . . . . 0.4 " C2'" ' C8 ' ' A' ' 5' ' ' ' A' . . . . . . . . 0 C2'--C1' 1.495 -3.262 1 C3'-C2'-C1' 106.208 5.232 . 0.019 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' A' . . . . . 0.507 " O2'" " C5'" ' A' ' 6' ' ' ' U' . . . . . . . . 1 C2'--C1' 1.486 -4.212 0 C3'-C2'-C1' 104.757 3.619 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ' U' . . . . . 0.507 " C5'" " O2'" ' A' ' 5' ' ' ' A' . . . . . . . . 0 C2'--C1' 1.491 -3.749 2 C3'-C2'-C1' 106.785 5.872 . 0.221 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.619 2.563 2 C3'-C2'-C1' 106.44 5.489 . 0.306 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ' A' . . . . . 0.467 " O2'" " C5'" ' A' ' 9' ' ' ' C' . . . . . . . . 1 C2'--C1' 1.486 -4.19 0 C3'-C2'-C1' 104.78 3.645 . 0.133 &a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ' C' . . . . . 0.467 " C5'" " O2'" ' A' ' 8' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.459 3.709 0 O4'-C1'-N19 111.777 3.577 . 0.414 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' OMG . . . . . 0.4 ' CM2' " O4'" ' B' ' 11' ' ' OMU . . . . . . . . 0 O4'--C1' 1.447 2.727 1 C3'-C2'-C1' 105.173 4.082 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' OMU . . . . . 0.4 " O4'" ' CM2' ' B' ' 10' ' ' OMG . . . . . . . . 0 C2'--C1' 1.494 -3.394 0 O4'-C1'-N19 111.546 3.346 . 0.467 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' OMC . . . . . 0.403 ' CM2' " O4'" ' B' ' 13' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.494 -3.372 1 C3'-C2'-C1' 105.311 4.235 . 0.718 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ' DA' . . . . . 0.403 " O4'" ' CM2' ' B' ' 12' ' ' OMC . . . . . . . . 0 C5'--C4' 1.538 3.371 0 O4'-C1'-N19 110.809 3.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.506 -2.2 1 O4'-C1'-N19 111.606 4.757 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.505 -2.321 1 O4'-C1'-N19 111.699 4.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 1.64 1 O4'-C1'-N19 111.464 4.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' OMC . . . . . 0.483 ' CM2' " O4'" ' B' ' 18' ' ' OMC . . . . . . . . 0 O4'--C1' 1.45 3.027 0 O4'-C1'-N19 112.185 3.985 . 0.137 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' OMC . . . . . 0.483 " O4'" ' CM2' ' B' ' 17' ' ' OMC . . . . . . . . 0 O4'--C1' 1.443 2.41 0 C3'-C2'-C1' 104.953 3.836 . 0.354 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.501 -2.675 1 C3'-C2'-C1' 106.672 5.747 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.56 ' H8 ' " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.228 1 C3'-C2'-C1' 106.209 5.233 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' A' . . . . . 0.534 ' C8 ' " H2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.446 2.675 0 C5'-C4'-C3' 111.531 -2.646 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' G' . . . . . 0.697 " H2'" ' N7 ' ' A' ' 5' ' ' ' A' . . . . . . . . 0 C2'--C1' 1.495 -3.262 1 C3'-C2'-C1' 106.208 5.232 . 0.019 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' A' . . . . . 0.871 " O2'" " H5'" ' A' ' 6' ' ' ' U' . . . . . . . . 1 C2'--C1' 1.486 -4.212 0 C3'-C2'-C1' 104.757 3.619 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ' U' . . . . . 0.871 " H5'" " O2'" ' A' ' 5' ' ' ' A' . . . . . . . . 0 C2'--C1' 1.491 -3.749 2 C3'-C2'-C1' 106.785 5.872 . 0.221 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' G' . . . . . 0.407 ' H8 ' " H2'" ' A' ' 6' ' ' ' U' . . . . . . . . 0 P--O5' 1.619 2.563 2 C3'-C2'-C1' 106.44 5.489 . 0.306 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ' A' . . . . . 0.845 " O2'" " H5'" ' A' ' 9' ' ' ' C' . . . . . . . . 1 C2'--C1' 1.486 -4.19 0 C3'-C2'-C1' 104.78 3.645 . 0.133 &a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ' C' . . . . . 0.845 " H5'" " O2'" ' A' ' 8' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.459 3.709 0 O4'-C1'-N19 111.777 3.577 . 0.414 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' OMG . . . . . 0.52 HM22 ' C6 ' ' B' ' 11' ' ' OMU . . . . . . . . 0 O4'--C1' 1.447 2.727 1 C3'-C2'-C1' 105.173 4.082 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' OMU . . . . . 0.828 " H2'" " O4'" ' B' ' 12' ' ' OMC . . . . . . . . 0 C2'--C1' 1.494 -3.394 0 O4'-C1'-N19 111.546 3.346 . 0.467 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' OMC . . . . . 0.828 " O4'" " H2'" ' B' ' 11' ' ' OMU . . . . . . . . 0 C2'--C1' 1.494 -3.372 1 C3'-C2'-C1' 105.311 4.235 . 0.718 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ' DA' . . . . . 0.606 ' C8 ' HM22 ' B' ' 12' ' ' OMC . . . . . . . . 0 C5'--C4' 1.538 3.371 0 O4'-C1'-N19 110.809 3.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ' DT' . . . . . 0.595 " H5'" H2'' ' B' ' 13' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.506 -2.2 1 O4'-C1'-N19 111.606 4.757 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ' DC' . . . . . 0.565 " H2'" ' C6 ' ' B' ' 16' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.505 -2.321 1 O4'-C1'-N19 111.699 4.874 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ' DT' . . . . . 0.724 H2'' " O4'" ' B' ' 17' ' ' OMC . . . . . . . . 0 O4'--C1' 1.441 1.64 1 O4'-C1'-N19 111.464 4.58 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' OMC . . . . . 1.016 HM22 " O4'" ' B' ' 18' ' ' OMC . . . . . . . . 0 O4'--C1' 1.45 3.027 0 O4'-C1'-N19 112.185 3.985 . 0.137 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' OMC . . . . . 1.016 " O4'" HM22 ' B' ' 17' ' ' OMC . . . . . . . . 0 O4'--C1' 1.443 2.41 0 C3'-C2'-C1' 104.953 3.836 . 0.354 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.501 -2.675 1 C3'-C2'-C1' 106.672 5.747 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.56 ' H8 ' " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.228 1 C3'-C2'-C1' 106.209 5.233 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' A' . . . . . 0.534 ' C8 ' " H2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.446 2.675 0 C5'-C4'-C3' 111.531 -2.646 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' G' . . . . . 0.697 " H2'" ' N7 ' ' A' ' 5' ' ' ' A' . . . . . . . . 0 C2'--C1' 1.495 -3.262 1 C3'-C2'-C1' 106.208 5.232 . 0.019 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' A' . . . . . 0.871 " O2'" " H5'" ' A' ' 6' ' ' ' U' . . . . . . . . 1 C2'--C1' 1.486 -4.212 0 C3'-C2'-C1' 104.757 3.619 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ' U' . . . . . 0.871 " H5'" " O2'" ' A' ' 5' ' ' ' A' . . . . . . . . 0 C2'--C1' 1.491 -3.749 2 C3'-C2'-C1' 106.785 5.872 . 0.221 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' G' . . . . . 0.407 ' H8 ' " H2'" ' A' ' 6' ' ' ' U' . . . . . . . . 0 P--O5' 1.619 2.563 2 C3'-C2'-C1' 106.44 5.489 . 0.306 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ' A' . . . . . 0.845 " O2'" " H5'" ' A' ' 9' ' ' ' C' . . . . . . . . 1 C2'--C1' 1.486 -4.19 0 C3'-C2'-C1' 104.78 3.645 . 0.133 &a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ' C' . . . . . 0.845 " H5'" " O2'" ' A' ' 8' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.459 3.709 0 O4'-C1'-N19 111.777 3.577 . 0.414 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' OMG . . . . . 0.52 HM22 ' C6 ' ' B' ' 11' ' ' OMU . . . . . . . . 0 O4'--C1' 1.447 2.727 1 C3'-C2'-C1' 105.173 4.082 . 0.0 '__' . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' OMU . . . . . 0.828 " H2'" " O4'" ' B' ' 12' ' ' OMC . . . . . . . . 0 C2'--C1' 1.494 -3.394 0 O4'-C1'-N19 111.546 3.346 . 0.467 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' OMC . . . . . 0.828 " O4'" " H2'" ' B' ' 11' ' ' OMU . . . . . . . . 0 C2'--C1' 1.494 -3.372 1 C3'-C2'-C1' 105.311 4.235 . 0.718 1a . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ' DA' . . . . . 0.606 ' C8 ' HM22 ' B' ' 12' ' ' OMC . . . . . . . . 0 C5'--C4' 1.538 3.371 0 O4'-C1'-N19 110.809 3.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ' DT' . . . . . 0.595 " H5'" H2'' ' B' ' 13' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.506 -2.2 1 O4'-C1'-N19 111.606 4.757 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ' DC' . . . . . 0.565 " H2'" ' C6 ' ' B' ' 16' ' ' ' DT' . . . . . . . . 0 C4'--C3' 1.505 -2.321 1 O4'-C1'-N19 111.699 4.874 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ' DT' . . . . . 0.724 H2'' " O4'" ' B' ' 17' ' ' OMC . . . . . . . . 0 O4'--C1' 1.441 1.64 1 O4'-C1'-N19 111.464 4.58 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' OMC . . . . . 1.016 HM22 " O4'" ' B' ' 18' ' ' OMC . . . . . . . . 0 O4'--C1' 1.45 3.027 0 O4'-C1'-N19 112.185 3.985 . 0.137 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' OMC . . . . . 1.016 " O4'" HM22 ' B' ' 17' ' ' OMC . . . . . . . . 0 O4'--C1' 1.443 2.41 0 C3'-C2'-C1' 104.953 3.836 . 0.354 1a . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_