data_1au5_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 1au5 _Structure_validation_residue.Date_analyzed 2016-10-06 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' ' ' ' DC' . . . . . 0.587 H2'' ' C6 ' ' A' ' 2' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.437 1.297 2 O4'-C1'-N19 113.319 6.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' DC' . . . . . 0.587 ' C6 ' H2'' ' A' ' 1' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.159 2 O4'-C1'-N19 114.798 8.747 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 2 C5'--C4' 1.57 7.34 1 O4'-C1'-N19 111.758 4.947 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' DG' . . . . . 0.429 ' N2 ' ' C2 ' ' B' ' 14' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.655 3 O4'-C1'-N19 116.822 11.278 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' DG' . . . . . 0.45 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.288 2 O4'-C1'-N19 115.836 10.046 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ' DT' . . . . . 0.45 ' C2 ' ' C2 ' ' A' ' 5' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.428 0 O4'-C4'-C3' 108.342 2.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' DC' . . . . . 0.45 ' O2 ' ' C2 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.476 -3.221 2 O4'-C1'-N19 113.603 7.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.728 1 O5'-C5'-C4' 116.202 4.287 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ' DG' . . . . . 0.485 " H2'" HO5' ' B' ' 9' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.643 2 O4'-C1'-N19 115.008 9.01 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ' DG' . . . . . 0.527 ' C2 ' ' C4 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.437 1.316 0 O3'-P-O5' 96.675 -3.855 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.877 H2'' " O4'" ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.491 -2.672 0 O4'-C4'-C3' 109.105 3.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.877 " O4'" H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.063 2 O4'-C1'-N19 120.866 16.332 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ' DC' . . . . . 0.7 H2'' " O4'" ' B' ' 14' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.777 1 C5'-C4'-O4' 117.323 4.952 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ' DA' . . . . . 0.7 " O4'" H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.547 2.889 3 O4'-C1'-C2' 99.809 -5.719 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ' DG' . . . . . 0.665 ' OP2' " H2'" ' B' ' 15' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.93 2 P-O3'-C3' 125.37 4.725 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ' DG' . . . . . 0.464 ' C4 ' ' C2 ' ' B' ' 15' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.549 4.798 2 O4'-C1'-N19 118.89 13.862 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CPT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' DC' . . . . . 0.601 H2'' ' C6 ' ' A' ' 2' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.437 1.297 2 O4'-C1'-N19 113.319 6.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' DC' . . . . . 0.601 ' C6 ' H2'' ' A' ' 1' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.159 2 O4'-C1'-N19 114.798 8.747 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 2 C5'--C4' 1.57 7.34 1 O4'-C1'-N19 111.758 4.947 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' DG' . . . . . 0.429 ' N2 ' ' C2 ' ' B' ' 14' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.655 3 O4'-C1'-N19 116.822 11.278 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' DG' . . . . . 0.45 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.288 2 O4'-C1'-N19 115.836 10.046 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ' DT' . . . . . 0.45 ' C2 ' ' C2 ' ' A' ' 5' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.428 0 O4'-C4'-C3' 108.342 2.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' DC' . . . . . 0.45 ' O2 ' ' C2 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.476 -3.221 2 O4'-C1'-N19 113.603 7.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.728 1 O5'-C5'-C4' 116.202 4.287 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ' DG' . . . . . 0.407 ' N2 ' ' C4 ' ' B' ' 10' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.643 2 O4'-C1'-N19 115.008 9.01 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ' DG' . . . . . 0.527 ' C2 ' ' C4 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.437 1.316 0 O3'-P-O5' 96.675 -3.855 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.844 H2'' " O4'" ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.491 -2.672 0 O4'-C4'-C3' 109.105 3.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.844 " O4'" H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.063 2 O4'-C1'-N19 120.866 16.332 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ' DC' . . . . . 0.694 H2'' " O4'" ' B' ' 14' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.777 1 C5'-C4'-O4' 117.323 4.952 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ' DA' . . . . . 0.694 " O4'" H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.547 2.889 3 O4'-C1'-C2' 99.809 -5.719 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ' DG' . . . . . 0.629 ' OP2' " H2'" ' B' ' 15' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.93 2 P-O3'-C3' 125.37 4.725 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ' DG' . . . . . 0.464 ' C4 ' ' C2 ' ' B' ' 15' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.549 4.798 2 O4'-C1'-N19 118.89 13.862 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CPT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' DC' . . . . . 0.601 H2'' ' C6 ' ' A' ' 2' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.437 1.297 2 O4'-C1'-N19 113.319 6.898 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' DC' . . . . . 0.601 ' C6 ' H2'' ' A' ' 1' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.159 2 O4'-C1'-N19 114.798 8.747 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 2 C5'--C4' 1.57 7.34 1 O4'-C1'-N19 111.758 4.947 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.429 ' N2 ' ' C2 ' ' B' ' 14' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.655 3 O4'-C1'-N19 116.822 11.278 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' DG' . . . . . 0.45 ' C2 ' ' C2 ' ' A' ' 6' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.537 3.288 2 O4'-C1'-N19 115.836 10.046 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ' DT' . . . . . 0.45 ' C2 ' ' C2 ' ' A' ' 5' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.428 0 O4'-C4'-C3' 108.342 2.742 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' DC' . . . . . 0.45 ' O2 ' ' C2 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.476 -3.221 2 O4'-C1'-N19 113.603 7.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.728 1 O5'-C5'-C4' 116.202 4.287 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ' DG' . . . . . 0.407 ' N2 ' ' C4 ' ' B' ' 10' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.643 2 O4'-C1'-N19 115.008 9.01 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ' DG' . . . . . 0.527 ' C2 ' ' C4 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.437 1.316 0 O3'-P-O5' 96.675 -3.855 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.844 H2'' " O4'" ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.491 -2.672 0 O4'-C4'-C3' 109.105 3.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.844 " O4'" H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.536 3.063 2 O4'-C1'-N19 120.866 16.332 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ' DC' . . . . . 0.694 H2'' " O4'" ' B' ' 14' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.541 3.777 1 C5'-C4'-O4' 117.323 4.952 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ' DA' . . . . . 0.694 " O4'" H2'' ' B' ' 13' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.547 2.889 3 O4'-C1'-C2' 99.809 -5.719 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ' DG' . . . . . 0.629 ' OP2' " H2'" ' B' ' 15' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.93 2 P-O3'-C3' 125.37 4.725 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ' DG' . . . . . 0.464 ' C4 ' ' C2 ' ' B' ' 15' ' ' ' DG' . . . . . . . . 1 C5'--C4' 1.549 4.798 2 O4'-C1'-N19 118.89 13.862 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CPT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_