NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
628559 | 5xol | cing | 2-parsed | STAR | dihedral angle | 64 |
data_5xol_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5xol _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project" NMR . parsed_5xol 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5xol _Entry.Title "Original constraint list(s)" _Entry.Version_type original _Entry.Submission_date . _Entry.Accession_date . _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination . _Entry.NMR_STAR_version 3.1 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 5xol "Master copy" parsed_5xol stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5xol _Constraint_stat_list.ID 1 loop_ _Constraint_file.ID _Constraint_file.Constraint_filename _Constraint_file.Software_ID _Constraint_file.Software_label _Constraint_file.Software_name _Constraint_file.Block_ID _Constraint_file.Constraint_type _Constraint_file.Constraint_subtype _Constraint_file.Constraint_subsubtype _Constraint_file.Constraint_number _Constraint_file.Entry_ID _Constraint_file.Constraint_stat_list_ID 1 5xol.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5xol 1 1 5xol.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 64 parsed_5xol 1 1 5xol.mr . . DYANA/DIANA 3 distance NOE simple 0 parsed_5xol 1 1 5xol.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5xol 1 stop_ save_ save_DYANA/DIANA_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_5xol _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID 1 _Torsion_angle_constraint_list.Block_ID 2 _Torsion_angle_constraint_list.Details "Generated by Wattos" loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Assembly_atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Seq_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Resonance_ID_1 _Torsion_angle_constraint.Assembly_atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Seq_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Resonance_ID_2 _Torsion_angle_constraint.Assembly_atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Seq_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Resonance_ID_3 _Torsion_angle_constraint.Assembly_atom_ID_4 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Seq_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Resonance_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Source_experiment_ID _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.11 -89.11 . . 2 SER . . . . . . . . . . . . . parsed_5xol 1 2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.11 -46.11 . . 2 SER . . . . . . . . . . . . . parsed_5xol 1 3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.80 -91.80 . . 3 LYS . . . . . . . . . . . . . parsed_5xol 1 4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.56 173.56 . . 3 LYS . . . . . . . . . . . . . parsed_5xol 1 5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.48 -98.48 . . 4 LYS . . . . . . . . . . . . . parsed_5xol 1 6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.32 130.32 . . 4 LYS . . . . . . . . . . . . . parsed_5xol 1 7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.75 -100.75 . . 6 VAL . . . . . . . . . . . . . parsed_5xol 1 8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.30 170.30 . . 6 VAL . . . . . . . . . . . . . parsed_5xol 1 9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.17 -63.17 . . 8 ILE . . . . . . . . . . . . . parsed_5xol 1 10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.32 177.32 . . 8 ILE . . . . . . . . . . . . . parsed_5xol 1 11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.03 -79.03 . . 9 ILE . . . . . . . . . . . . . parsed_5xol 1 12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.13 170.13 . . 9 ILE . . . . . . . . . . . . . parsed_5xol 1 13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.94 -105.94 . . 10 TYR . . . . . . . . . . . . . parsed_5xol 1 14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 78.97 128.97 . . 10 TYR . . . . . . . . . . . . . parsed_5xol 1 15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.92 -94.92 . . 11 CYSS . . . . . . . . . . . . . parsed_5xol 1 16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.55 156.55 . . 11 CYSS . . . . . . . . . . . . . parsed_5xol 1 17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.7 -86.7 . . 12 ASN . . . . . . . . . . . . . parsed_5xol 1 18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.3 156.3 . . 12 ASN . . . . . . . . . . . . . parsed_5xol 1 19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.4 -46.4 . . 13 ALA . . . . . . . . . . . . . parsed_5xol 1 20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.4 155.4 . . 13 ALA . . . . . . . . . . . . . parsed_5xol 1 21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.1 -78.1 . . 14 ALA . . . . . . . . . . . . . parsed_5xol 1 22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.6 184.6 . . 14 ALA . . . . . . . . . . . . . parsed_5xol 1 23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.7 -62.7 . . 15 THR . . . . . . . . . . . . . parsed_5xol 1 24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.4 184.4 . . 15 THR . . . . . . . . . . . . . parsed_5xol 1 25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.45 -115.45 . . 17 LYS . . . . . . . . . . . . . parsed_5xol 1 26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.27 152.27 . . 17 LYS . . . . . . . . . . . . . parsed_5xol 1 27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.85 -97.85 . . 18 CYSS . . . . . . . . . . . . . parsed_5xol 1 28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136.10 186.10 . . 18 CYSS . . . . . . . . . . . . . parsed_5xol 1 29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183.33 -133.33 . . 19 GLN . . . . . . . . . . . . . parsed_5xol 1 30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -191.95 -141.95 . . 19 GLN . . . . . . . . . . . . . parsed_5xol 1 31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.00 -88.00 . . 20 ARG . . . . . . . . . . . . . parsed_5xol 1 32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.71 174.71 . . 20 ARG . . . . . . . . . . . . . parsed_5xol 1 33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -139.11 -89.11 . . 34 SER . . . . . . . . . . . . . parsed_5xol 1 34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.11 -46.11 . . 34 SER . . . . . . . . . . . . . parsed_5xol 1 35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.80 -91.80 . . 35 LYS . . . . . . . . . . . . . parsed_5xol 1 36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123.56 173.56 . . 35 LYS . . . . . . . . . . . . . parsed_5xol 1 37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -148.48 -98.48 . . 36 LYS . . . . . . . . . . . . . parsed_5xol 1 38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.32 130.32 . . 36 LYS . . . . . . . . . . . . . parsed_5xol 1 39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.75 -100.75 . . 38 VAL . . . . . . . . . . . . . parsed_5xol 1 40 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.30 170.30 . . 38 VAL . . . . . . . . . . . . . parsed_5xol 1 41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.17 -63.17 . . 40 ILE . . . . . . . . . . . . . parsed_5xol 1 42 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.32 177.32 . . 40 ILE . . . . . . . . . . . . . parsed_5xol 1 43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -129.03 -79.03 . . 41 ILE . . . . . . . . . . . . . parsed_5xol 1 44 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.13 170.13 . . 41 ILE . . . . . . . . . . . . . parsed_5xol 1 45 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.94 -105.94 . . 42 TYR . . . . . . . . . . . . . parsed_5xol 1 46 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 78.97 128.97 . . 42 TYR . . . . . . . . . . . . . parsed_5xol 1 47 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.92 -94.92 . . 43 CYSS . . . . . . . . . . . . . parsed_5xol 1 48 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.55 156.55 . . 43 CYSS . . . . . . . . . . . . . parsed_5xol 1 49 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -136.7 -86.7 . . 44 ASN . . . . . . . . . . . . . parsed_5xol 1 50 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 106.3 156.3 . . 44 ASN . . . . . . . . . . . . . parsed_5xol 1 51 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.4 -46.4 . . 45 ALA . . . . . . . . . . . . . parsed_5xol 1 52 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 105.4 155.4 . . 45 ALA . . . . . . . . . . . . . parsed_5xol 1 53 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.1 -78.1 . . 46 ALA . . . . . . . . . . . . . parsed_5xol 1 54 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.6 184.6 . . 46 ALA . . . . . . . . . . . . . parsed_5xol 1 55 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.7 -62.7 . . 47 THR . . . . . . . . . . . . . parsed_5xol 1 56 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.4 184.4 . . 47 THR . . . . . . . . . . . . . parsed_5xol 1 57 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.45 -115.45 . . 49 LYS . . . . . . . . . . . . . parsed_5xol 1 58 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 102.27 152.27 . . 49 LYS . . . . . . . . . . . . . parsed_5xol 1 59 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -147.85 -97.85 . . 50 CYSS . . . . . . . . . . . . . parsed_5xol 1 60 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 136.10 186.10 . . 50 CYSS . . . . . . . . . . . . . parsed_5xol 1 61 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -183.33 -133.33 . . 51 GLN . . . . . . . . . . . . . parsed_5xol 1 62 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -191.95 -141.95 . . 51 GLN . . . . . . . . . . . . . parsed_5xol 1 63 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -138.00 -88.00 . . 52 ARG . . . . . . . . . . . . . parsed_5xol 1 64 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124.71 174.71 . . 52 ARG . . . . . . . . . . . . . parsed_5xol 1 stop_ loop_ _TA_constraint_comment_org.ID _TA_constraint_comment_org.Comment_text _TA_constraint_comment_org.Comment_begin_line _TA_constraint_comment_org.Comment_begin_column _TA_constraint_comment_org.Comment_end_line _TA_constraint_comment_org.Comment_end_column _TA_constraint_comment_org.Entry_ID _TA_constraint_comment_org.Torsion_angle_constraint_list_ID 1 "Restraints file 1: r.aco" 1 1 1 26 parsed_5xol 1 2 "Torsion angle constraints" 2 1 2 28 parsed_5xol 1 3 "generated from HA secondary chemical shifts" 3 1 3 45 parsed_5xol 1 stop_ save_
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