data_1wts_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 1wts _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 O3'--C3' 1.442 1.329 0 C4'-C3'-C2' 99.037 -3.663 . 0.0 '__' . 1.36 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.679 0 P-O3'-C3' 123.403 3.086 . 0.571 1a . 1.35 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.442 2.26 2 C3'-C2'-C1' 96.78 -5.244 . 0.184 1a . 0.92 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.436 1.748 2 C3'-C2'-C1' 97.348 -4.614 . 0.127 1a . 0.69 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.442 1.346 1 O4'-C1'-N19 113.525 5.325 . 0.426 1a . 0.72 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' 2MG . . . . . 0.51 ' HN2' ' C5 ' ' A' ' 9' ' ' MA6 . . . . . . . . 0 P--O5' 1.61 1.651 0 C3'-C2'-C1' 99.304 -2.44 . 0.671 1a . 1.12 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.447 1.687 1 O4'-C1'-C2' 100.225 -4.411 . 0.0 OUTLIER . 1.92 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MA6 . . . . . 0.43 ' H91' ' N7 ' ' A' ' 8' ' ' MA6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' MA6 . . . . . 0.717 ' H91' ' N7 ' ' A' ' 9' ' ' MA6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 1.921 2 C5'-C4'-O4' 115.814 4.724 . 0.0 OUTLIER gamma 1.43 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.484 ' C6 ' ' C5 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 C2'--O2' 1.444 2.349 2 C3'-C2'-C1' 96.273 -5.808 . 0.42 1a . 0.66 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.484 ' C5 ' ' C6 ' ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.431 1.388 0 O4'-C1'-N19 112.167 3.967 . 0.445 1a . 0.91 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -1.789 1 C3'-C2'-C1' 105.685 4.65 . 0.861 1a . 0.83 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.016 1 O4'-C1'-N19 118.285 10.085 . 0.528 1a . 1.57 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.442 1.329 0 C4'-C3'-C2' 99.037 -3.663 . 0.0 '__' . 1.27 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.679 0 P-O3'-C3' 123.403 3.086 . 0.571 1a . 1.3500000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.442 2.26 2 C3'-C2'-C1' 96.78 -5.244 . 0.184 1a . 0.92000000000000004 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.436 1.748 2 C3'-C2'-C1' 97.348 -4.614 . 0.127 1a . 0.68999999999999995 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.442 1.346 1 O4'-C1'-N19 113.525 5.325 . 0.426 1a . 0.71999999999999997 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' 2MG . . . . . 0.495 ' HN2' ' C5 ' ' A' ' 9' ' ' MA6 . . . . . . . . 0 P--O5' 1.61 1.651 0 C3'-C2'-C1' 99.304 -2.44 . 0.671 1a . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' G' . . . . . 0.774 ' C8 ' ' H91' ' A' ' 9' ' ' MA6 . . . . . . . . 0 O3'--C3' 1.447 1.687 1 O4'-C1'-C2' 100.225 -4.411 . 0.0 OUTLIER . 1.6899999999999999 . . . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MA6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 9' ' ' MA6 . . . . . 0.774 ' H91' ' C8 ' ' A' ' 7' ' ' ' G' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 1.921 2 C5'-C4'-O4' 115.814 4.724 . 0.0 OUTLIER gamma 1.24 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.484 ' C6 ' ' C5 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 C2'--O2' 1.444 2.349 2 C3'-C2'-C1' 96.273 -5.808 . 0.42 1a . 0.66000000000000003 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.484 ' C5 ' ' C6 ' ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.431 1.388 0 O4'-C1'-N19 112.167 3.967 . 0.445 1a . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -1.789 1 C3'-C2'-C1' 105.685 4.65 . 0.861 1a . 0.82999999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.016 1 O4'-C1'-N19 118.285 10.085 . 0.528 1a . 1.21 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.442 1.329 0 C4'-C3'-C2' 99.037 -3.663 . 0.0 '__' . 1.27 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.61 1.679 0 P-O3'-C3' 123.403 3.086 . 0.571 1a . 1.35 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' A' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.442 2.26 2 C3'-C2'-C1' 96.78 -5.244 . 0.184 1a . 0.92 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C2'--O2' 1.436 1.748 2 C3'-C2'-C1' 97.348 -4.614 . 0.127 1a . 0.69 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.442 1.346 1 O4'-C1'-N19 113.525 5.325 . 0.426 1a . 0.72 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' 2MG . . . . . 0.495 ' HN2' ' C5 ' ' A' ' 9' ' ' MA6 . . . . . . . . 0 P--O5' 1.61 1.651 0 C3'-C2'-C1' 99.304 -2.44 . 0.671 1a . 0.85 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' G' . . . . . 0.774 ' C8 ' ' H91' ' A' ' 9' ' ' MA6 . . . . . . . . 0 O3'--C3' 1.447 1.687 1 O4'-C1'-C2' 100.225 -4.411 . 0.0 OUTLIER . 1.69 . . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MA6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' MA6 . . . . . 0.774 ' H91' ' C8 ' ' A' ' 7' ' ' ' G' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 1.921 2 C5'-C4'-O4' 115.814 4.724 . 0.0 OUTLIER gamma 1.24 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.484 ' C6 ' ' C5 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 C2'--O2' 1.444 2.349 2 C3'-C2'-C1' 96.273 -5.808 . 0.42 1a . 0.66 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.484 ' C5 ' ' C6 ' ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.431 1.388 0 O4'-C1'-N19 112.167 3.967 . 0.445 1a . 0.91 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.51 -1.789 1 C3'-C2'-C1' 105.685 4.65 . 0.861 1a . 0.83 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.016 1 O4'-C1'-N19 118.285 10.085 . 0.528 1a . 1.21 . . . . . . . . . . 1 1 . 1 stop_ save_