data_3sgo_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 3sgo _Structure_validation_residue.Date_analyzed 2016-10-12 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' ' ' LYS . . . . . . . . . . . . . 69.7 tttt . . . . . 0 N--CA 1.48 1.034 0 N-CA-C 108.836 -0.802 . . . . 50.32 108.836 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.4 t -85.26 134.36 27.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 107.558 -1.275 . . . . 44.490000000000002 107.558 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.47 169.93 16.67 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.727 -0.842 . . . . 37.969999999999999 108.727 176.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.7 t -116.83 131.77 68.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.303 0 N-CA-C 109.016 -0.735 . . . . 34.939999999999998 109.016 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.9 tp -130.0 130.29 44.81 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 125.023 1.452 . . . . 35.840000000000003 107.514 177.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -161.57 -169.07 24.36 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.335 -1.412 . . . . 32.43 112.576 -176.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -130.29 150.5 51.5 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-N 112.937 -1.631 . . . . 43.670000000000002 111.126 -172.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 48.8 t -90.7 121.73 41.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 106.437 -1.69 . . . . 49.840000000000003 106.437 169.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.3 pt -125.22 160.53 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 109.389 -0.597 . . . . 44.07 109.389 -175.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -99.39 127.15 45.4 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 106.31 -1.737 . . . . 77.260000000000005 106.31 172.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 121.535 0.683 . . . . 50.409999999999997 110.292 171.748 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 69.7 tttt . . . . . 0 N--CA 1.48 1.034 0 N-CA-C 108.836 -0.802 . . . . 50.32 108.836 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.4 t -85.26 134.36 27.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 107.558 -1.275 . . . . 44.49 107.558 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.47 169.93 16.67 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.727 -0.842 . . . . 37.97 108.727 176.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.7 t -116.83 131.77 68.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.303 0 N-CA-C 109.016 -0.735 . . . . 34.94 109.016 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.9 tp -130.0 130.29 44.81 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 125.023 1.452 . . . . 35.84 107.514 177.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -161.57 -169.07 24.36 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.335 -1.412 . . . . 32.43 112.576 -176.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -130.29 150.5 51.5 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-N 112.937 -1.631 . . . . 43.67 111.126 -172.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 48.8 t -90.7 121.73 41.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 106.437 -1.69 . . . . 49.84 106.437 169.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.3 pt -125.22 160.53 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 109.389 -0.597 . . . . 44.07 109.389 -175.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -99.39 127.15 45.4 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 106.31 -1.737 . . . . 77.26 106.31 172.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 121.535 0.683 . . . . 50.41 110.292 171.748 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 69.7 tttt . . . . . 0 N--CA 1.48 1.034 0 N-CA-C 108.836 -0.802 . . . . 50.32 108.836 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.4 t -85.26 134.36 27.28 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 107.558 -1.275 . . . . 44.490000000000002 107.558 177.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.47 169.93 16.67 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.727 -0.842 . . . . 37.969999999999999 108.727 176.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 43.7 t -116.83 131.77 68.5 Favored 'Isoleucine or valine' 0 C--O 1.254 1.303 0 N-CA-C 109.016 -0.735 . . . . 34.939999999999998 109.016 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 38.9 tp -130.0 130.29 44.81 Favored 'General case' 0 C--O 1.238 0.465 0 O-C-N 125.023 1.452 . . . . 35.840000000000003 107.514 177.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -161.57 -169.07 24.36 Favored Glycine 0 N--CA 1.435 -1.401 0 C-N-CA 119.335 -1.412 . . . . 32.43 112.576 -176.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -130.29 150.5 51.5 Favored 'General case' 0 C--O 1.248 0.977 0 CA-C-N 112.937 -1.631 . . . . 43.670000000000002 111.126 -172.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 48.8 t -90.7 121.73 41.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 106.437 -1.69 . . . . 49.840000000000003 106.437 169.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 22.3 pt -125.22 160.53 30.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 N-CA-C 109.389 -0.597 . . . . 44.07 109.389 -175.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -99.39 127.15 45.4 Favored 'General case' 0 C--O 1.213 -0.83 0 N-CA-C 106.31 -1.737 . . . . 77.260000000000005 106.31 172.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 121.535 0.683 . . . . 50.409999999999997 110.292 171.748 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_