NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
633914 | 5yzk | cing | 2-parsed | STAR | dihedral angle | 24 |
data_5yzk_MR_file_constraints save_Conversion_project _Study_list.Sf_category study_list _Study_list.Entry_ID parsed_5yzk _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_5yzk 1 stop_ save_ save_entry_information _Entry.Sf_category entry_information _Entry.ID parsed_5yzk _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 5yzk "Master copy" parsed_5yzk stop_ save_ save_global_Org_file_characteristics _Constraint_stat_list.Sf_category constraint_statistics _Constraint_stat_list.Entry_ID parsed_5yzk _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 5yzk.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5yzk 1 1 5yzk.mr . . DYANA/DIANA 2 "dihedral angle" "Not applicable" "Not applicable" 24 parsed_5yzk 1 1 5yzk.mr . . DYANA/DIANA 3 distance "general distance" simple 0 parsed_5yzk 1 1 5yzk.mr . . DYANA/DIANA 4 distance "hydrogen bond" simple 0 parsed_5yzk 1 1 5yzk.mr . . DYANA/DIANA 5 distance "general distance" simple 0 parsed_5yzk 1 1 5yzk.mr . . DYANA/DIANA 6 distance "hydrogen bond" simple 0 parsed_5yzk 1 1 5yzk.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5yzk 1 stop_ save_ save_DYANA/DIANA_dihedral_2 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID parsed_5yzk _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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -164.197 -111.999 . . 85 CYSS . . . . . . . . . . . . . parsed_5yzk 1 2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 134.966 166.7 . . 85 CYSS . . . . . . . . . . . . . parsed_5yzk 1 3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -150.971 -123.583 . . 86 THR . . . . . . . . . . . . . parsed_5yzk 1 4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.253 168.599 . . 86 THR . . . . . . . . . . . . . parsed_5yzk 1 5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.264 -106.378 . . 87 TYR . . . . . . . . . . . . . parsed_5yzk 1 6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 113.347 136.575 . . 87 TYR . . . . . . . . . . . . . parsed_5yzk 1 7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -127.481 -89.117 . . 88 THR . . . . . . . . . . . . . parsed_5yzk 1 8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 111.531 141.241 . . 88 THR . . . . . . . . . . . . . parsed_5yzk 1 9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -116.593 -91.037 . . 89 ILE . . . . . . . . . . . . . parsed_5yzk 1 10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 109.633 137.309 . . 89 ILE . . . . . . . . . . . . . parsed_5yzk 1 11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.471 -63.957 . . 110 GLN . . . . . . . . . . . . . parsed_5yzk 1 12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -25.283 10.227 . . 110 GLN . . . . . . . . . . . . . parsed_5yzk 1 13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.218 -85.72 . . 121 LEU . . . . . . . . . . . . . parsed_5yzk 1 14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 89.031 180.333 . . 121 LEU . . . . . . . . . . . . . parsed_5yzk 1 15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -141.5 -97.776 . . 122 GLN . . . . . . . . . . . . . parsed_5yzk 1 16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 127.277 153.457 . . 122 GLN . . . . . . . . . . . . . parsed_5yzk 1 17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -142.198 -42.3 . . 123 VAL . . . . . . . . . . . . . parsed_5yzk 1 18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 104.716 164.64 . . 123 VAL . . . . . . . . . . . . . parsed_5yzk 1 19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.112 -95.142 . . 125 GLN . . . . . . . . . . . . . parsed_5yzk 1 20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.038 128.176 . . 125 GLN . . . . . . . . . . . . . parsed_5yzk 1 21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -115.575 -84.473 . . 126 VAL . . . . . . . . . . . . . parsed_5yzk 1 22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 112.001 146.203 . . 126 VAL . . . . . . . . . . . . . parsed_5yzk 1 23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -157.65 -123.534 . . 127 ILE . . . . . . . . . . . . . parsed_5yzk 1 24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 138.619 175.885 . . 127 ILE . . . . . . . . . . . . . parsed_5yzk 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: talos.aco" 1 1 1 30 parsed_5yzk 1 2 "Talos contraints =10 only" 2 1 2 26 parsed_5yzk 1 3 "84 GLY PHI 119.922 231.452" 3 1 3 47 parsed_5yzk 1 4 "84 GLY PSI -227.234 -126.72" 4 1 4 55 parsed_5yzk 1 5 "90 GLN PHI -135.658 -71.9" 15 1 15 53 parsed_5yzk 1 6 "90 GLN PSI 87.913 153.325" 16 1 16 47 parsed_5yzk 1 7 "91 PRO PSI 132.84 150.57" 17 1 17 46 parsed_5yzk 1 8 "92 GLY PHI -154.32 -94.19" 18 1 18 46 parsed_5yzk 1 9 "92 GLY PSI 129.168 173.764" 19 1 19 47 parsed_5yzk 1 10 "94 THR PHI -164.161 -129.317" 20 1 20 56 parsed_5yzk 1 11 "94 THR PSI 144.095 177.669" 21 1 21 47 parsed_5yzk 1 12 "96 TRP PHI 45.098 63.622" 22 1 22 46 parsed_5yzk 1 13 "96 TRP PSI 32.666 49.798" 23 1 23 46 parsed_5yzk 1 14 "98 ILE PHI -103.913 -82.899" 24 1 24 55 parsed_5yzk 1 15 "98 ILE PSI 0.581 23.817" 25 1 25 46 parsed_5yzk 1 16 "99 ALA PHI 51.516 66.956" 26 1 26 46 parsed_5yzk 1 17 "99 ALA PSI 22.789 36.651" 27 1 27 46 parsed_5yzk 1 18 "100 GLN PHI 37.397 92.017" 28 1 28 46 parsed_5yzk 1 19 "100 GLN PSI -2.362 57.662" 29 1 29 46 parsed_5yzk 1 20 "102 ARG PHI -108.709 -91.799" 30 1 30 55 parsed_5yzk 1 21 "102 ARG PSI 0.45 24.854" 31 1 31 46 parsed_5yzk 1 22 "104 THR PHI -164.241 -72.555" 32 1 32 55 parsed_5yzk 1 23 "104 THR PSI 88.976 174.02" 33 1 33 46 parsed_5yzk 1 24 "106 VAL PHI -84.556 -54.488" 34 1 34 47 parsed_5yzk 1 25 "106 VAL PSI -43.852 3.42" 35 1 35 44 parsed_5yzk 1 26 "107 ASP PHI 53.667 107.521" 36 1 36 47 parsed_5yzk 1 27 "107 ASP PSI -1.907 37.529" 37 1 37 46 parsed_5yzk 1 28 "108 VAL PHI -72.499 -55.973" 38 1 38 47 parsed_5yzk 1 29 "108 VAL PSI -40.535 -8.923" 39 1 39 46 parsed_5yzk 1 30 "109 ILE PHI -71.604 -58.572" 40 1 40 47 parsed_5yzk 1 31 "109 ILE PSI -45.358 -19.252" 41 1 41 47 parsed_5yzk 1 32 "111 SER PHI 46.551 80.609" 44 1 44 46 parsed_5yzk 1 33 "111 SER PSI 27.1 52.554" 45 1 45 46 parsed_5yzk 1 34 "113 ASN PHI -142.173 -80.191" 46 1 46 55 parsed_5yzk 1 35 "113 ASN PSI 76.467 151.815" 47 1 47 47 parsed_5yzk 1 36 "116 VAL PHI -124.59 -85.836" 48 1 48 47 parsed_5yzk 1 37 "116 VAL PSI 112.601 133.199" 49 1 49 47 parsed_5yzk 1 38 "117 ASN PHI -117.11 -64.268" 50 1 50 47 parsed_5yzk 1 39 "117 ASN PSI 98.403 155.333" 51 1 51 47 parsed_5yzk 1 40 "118 PRO PSI -31.465 0.093" 52 1 52 45 parsed_5yzk 1 41 "120 ARG PHI -142.444 -78.846" 53 1 53 55 parsed_5yzk 1 42 "120 ARG PSI 72.342 186.498" 54 1 54 47 parsed_5yzk 1 43 "124 GLY PHI -143.788 -72.69" 61 1 61 54 parsed_5yzk 1 44 "124 GLY PSI 95.144 188.01" 62 1 62 46 parsed_5yzk 1 45 "129 VAL PHI -148.452 -98.754" 69 1 69 55 parsed_5yzk 1 46 "129 VAL PSI 75.659 166.945" 70 1 70 47 parsed_5yzk 1 47 "130 PRO PSI 135.81 156.274" 71 1 71 47 parsed_5yzk 1 stop_ save_
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