data_6ros_residue ############################ # Computer software used # ############################ 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 6ros _Structure_validation_residue.Date_analyzed 2020-07-03 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 ecloud orig full ' A' A ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.715 0 C3'-C2'-C1' 100.254 -1.747 . . . . 93.23 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.98 0 O4'-C1'-N19 109.317 1.896 . . . . 94.49 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.393 -2.946 0 O4'-C4'-C3' 103.349 -2.251 . . . . 95.14 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.406 -2.095 0 C4'-C3'-C2' 101.174 -2.026 . . . . 98.11 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.397 -2.69 0 C4'-C3'-C2' 99.634 -3.566 . . . . 100.79 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.509 -1.895 0 O4'-C4'-C3' 103.117 -2.483 . . . . 109.75 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.381 -3.687 0 OP2-P-O3' 103.701 -1.437 . . . . 120.04 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.504 -2.421 0 OP1-P-OP2 115.884 -2.478 . . . . 122.73 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.356 0 O4'-C1'-N19 110.238 3.047 . . . . 137.73 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.391 -3.049 0 O4'-C1'-C2' 107.996 1.724 . . . . 159.81 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ' DG' . . . . . 0.545 ' O6 ' ' N4 ' ' A' ' 12' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.386 -3.424 0 P-O3'-C3' 121.281 1.317 . . . . 151.61 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ' DC' . . . . . 0.545 ' N4 ' ' O6 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.546 1.814 1 O4'-C1'-N19 112.695 6.119 . . . . 145.78 . . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.717 0 C4'-C3'-C2' 100.782 -2.418 . . . . 147.07 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.409 -1.911 0 C4'-C3'-C2' 100.564 -2.636 . . . . 133.06 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.384 -3.597 0 O4'-C4'-C3' 102.724 -2.876 . . . . 116.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.381 -3.818 0 O4'-C1'-N19 109.824 2.53 . . . . 98.25 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.398 -2.656 0 O4'-C4'-C3' 103.241 -2.359 . . . . 119.02 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.411 -1.783 0 C3'-C2'-C1' 99.24 -2.472 . . . . 132.7 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.715 0 C3'-C2'-C1' 100.254 -1.747 . . . . 93.23 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.98 0 O4'-C1'-N19 109.317 1.896 . . . . 94.49 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.393 -2.946 0 O4'-C4'-C3' 103.349 -2.251 . . . . 95.14 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ' DG' . . . . . 0.669 " H2'" ' H8 ' ' A' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.406 -2.095 0 C4'-C3'-C2' 101.174 -2.026 . . . . 98.11 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ' DG' . . . . . 0.669 ' H8 ' " H2'" ' A' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.397 -2.69 0 C4'-C3'-C2' 99.634 -3.566 . . . . 100.79 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.509 -1.895 0 O4'-C4'-C3' 103.117 -2.483 . . . . 109.75 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.381 -3.687 0 OP2-P-O3' 103.701 -1.437 . . . . 120.04 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.504 -2.421 0 OP1-P-OP2 115.884 -2.478 . . . . 122.73 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ' DT' . . . . . 0.447 " H2'" ' C6 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.356 0 O4'-C1'-N19 110.238 3.047 . . . . 137.73 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ' DT' . . . . . 0.447 ' C6 ' " H2'" ' A' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.391 -3.049 0 O4'-C1'-C2' 107.996 1.724 . . . . 159.81 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ' DG' . . . . . 0.545 ' O6 ' ' N4 ' ' A' ' 12' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.386 -3.424 0 P-O3'-C3' 121.281 1.317 . . . . 151.61 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ' DC' . . . . . 0.545 ' N4 ' ' O6 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.546 1.814 1 O4'-C1'-N19 112.695 6.119 . . . . 145.78 . . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ' DC' . . . . . 0.578 " H2'" ' H6 ' ' A' ' 14' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.413 -1.717 0 C4'-C3'-C2' 100.782 -2.418 . . . . 147.07 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ' DC' . . . . . 0.578 ' H6 ' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.409 -1.911 0 C4'-C3'-C2' 100.564 -2.636 . . . . 133.06 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.384 -3.597 0 O4'-C4'-C3' 102.724 -2.876 . . . . 116.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ' DA' . . . . . 0.502 " H2'" ' C6 ' ' A' ' 17' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.381 -3.818 0 O4'-C1'-N19 109.824 2.53 . . . . 98.25 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ' DC' . . . . . 0.502 ' C6 ' " H2'" ' A' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.398 -2.656 0 O4'-C4'-C3' 103.241 -2.359 . . . . 119.02 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.411 -1.783 0 C3'-C2'-C1' 99.24 -2.472 . . . . 132.7 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.413 -1.715 0 C3'-C2'-C1' 100.254 -1.747 . . . . 93.230000000000004 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.98 0 O4'-C1'-N19 109.317 1.896 . . . . 94.489999999999995 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.393 -2.946 0 O4'-C4'-C3' 103.349 -2.251 . . . . 95.140000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ' DG' . . . . . 0.669 " H2'" ' H8 ' ' A' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.406 -2.095 0 C4'-C3'-C2' 101.174 -2.026 . . . . 98.109999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ' DG' . . . . . 0.669 ' H8 ' " H2'" ' A' ' 4' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.397 -2.69 0 C4'-C3'-C2' 99.634 -3.566 . . . . 100.79000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.509 -1.895 0 O4'-C4'-C3' 103.117 -2.483 . . . . 109.75 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.381 -3.687 0 OP2-P-O3' 103.701 -1.437 . . . . 120.04000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.504 -2.421 0 OP1-P-OP2 115.884 -2.478 . . . . 122.73 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ' DT' . . . . . 0.447 " H2'" ' C6 ' ' A' ' 10' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.356 0 O4'-C1'-N19 110.238 3.047 . . . . 137.72999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ' DT' . . . . . 0.447 ' C6 ' " H2'" ' A' ' 9' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.391 -3.049 0 O4'-C1'-C2' 107.996 1.724 . . . . 159.81 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ' DG' . . . . . 0.545 ' O6 ' ' N4 ' ' A' ' 12' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.386 -3.424 0 P-O3'-C3' 121.281 1.317 . . . . 151.61000000000001 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ' DC' . . . . . 0.545 ' N4 ' ' O6 ' ' A' ' 11' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.546 1.814 1 O4'-C1'-N19 112.695 6.119 . . . . 145.78 . . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ' DC' . . . . . 0.578 " H2'" ' H6 ' ' A' ' 14' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.413 -1.717 0 C4'-C3'-C2' 100.782 -2.418 . . . . 147.06999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ' DC' . . . . . 0.578 ' H6 ' " H2'" ' A' ' 13' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.409 -1.911 0 C4'-C3'-C2' 100.564 -2.636 . . . . 133.06 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.384 -3.597 0 O4'-C4'-C3' 102.724 -2.876 . . . . 116.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ' DA' . . . . . 0.502 " H2'" ' C6 ' ' A' ' 17' ' ' ' DC' . . . . . . . . 0 O3'--C3' 1.381 -3.818 0 O4'-C1'-N19 109.824 2.53 . . . . 98.25 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ' DC' . . . . . 0.502 ' C6 ' " H2'" ' A' ' 16' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.398 -2.656 0 O4'-C4'-C3' 103.241 -2.359 . . . . 119.02 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.411 -1.783 0 C3'-C2'-C1' 99.24 -2.472 . . . . 132.69999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ' SR' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_