Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
654075 | 7jgx RC | 30775 | cing | 2-parsed | STAR | dihedral angle | 20 |
data_7jgx_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_7jgx
_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_7jgx 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_7jgx
_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 7jgx "Master copy" parsed_7jgx
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_7jgx
_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 7jgx.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_7jgx 1
1 7jgx.mr . . DYANA/DIANA 2 distance NOE simple 37 parsed_7jgx 1
1 7jgx.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 20 parsed_7jgx 1
1 7jgx.mr . . DYANA/DIANA 4 distance "hydrogen bond" simple 0 parsed_7jgx 1
1 7jgx.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_7jgx 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_7jgx
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.4 -43.4 . . 2 PHE . . . . . . . . . . . . . parsed_7jgx 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.3 -18.3 . . 2 PHE . . . . . . . . . . . . . parsed_7jgx 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.5 -44.5 . . 3 TRP . . . . . . . . . . . . . parsed_7jgx 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.3 -23.3 . . 3 TRP . . . . . . . . . . . . . parsed_7jgx 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.1 -46.1 . . 4 LEU . . . . . . . . . . . . . parsed_7jgx 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.9 -22.9 . . 4 LEU . . . . . . . . . . . . . parsed_7jgx 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.8 -45.8 . . 5 PHE . . . . . . . . . . . . . parsed_7jgx 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.5 -20.5 . . 5 PHE . . . . . . . . . . . . . parsed_7jgx 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.7 -44.7 . . 6 ARG . . . . . . . . . . . . . parsed_7jgx 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -62.7 -22.7 . . 6 ARG . . . . . . . . . . . . . parsed_7jgx 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.6 -45.6 . . 7 GLY . . . . . . . . . . . . . parsed_7jgx 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.9 -19.9 . . 7 GLY . . . . . . . . . . . . . parsed_7jgx 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.5 -45.5 . . 8 LYS . . . . . . . . . . . . . parsed_7jgx 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.6 -19.6 . . 8 LYS . . . . . . . . . . . . . parsed_7jgx 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -86.1 -46.1 . . 9 ALA . . . . . . . . . . . . . parsed_7jgx 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.5 -19.5 . . 9 ALA . . . . . . . . . . . . . parsed_7jgx 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 10 ASP . . . . . . . . . . . . . parsed_7jgx 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.4 -20.4 . . 10 ASP . . . . . . . . . . . . . parsed_7jgx 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -84.0 -44.0 . . 11 VAL . . . . . . . . . . . . . parsed_7jgx 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.5 -15.5 . . 11 VAL . . . . . . . . . . . . . parsed_7jgx 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 "dihedral angle restraints" 1 1 1 26 parsed_7jgx 1
2 "2 F -63.375 -38.333 5.018 4.268 1.066 0.851 25 11 Strong" 3 1 3 72 parsed_7jgx 1
3 "3 W -64.493 -43.330 4.703 5.660 0.836 0.854 25 13 Strong" 7 1 7 72 parsed_7jgx 1
4 "4 L -66.123 -42.857 4.335 4.374 0.715 0.856 25 15 Strong" 11 1 11 72 parsed_7jgx 1
5 "5 F -65.779 -40.472 5.555 5.283 0.598 0.848 25 15 Strong" 15 1 15 72 parsed_7jgx 1
6 "6 R -64.652 -42.667 3.776 5.187 0.529 0.841 25 14 Strong" 19 1 19 72 parsed_7jgx 1
7 "7 G -65.572 -39.927 3.721 3.664 0.483 0.835 25 14 Strong" 23 1 23 72 parsed_7jgx 1
8 "8 K -65.487 -39.557 3.647 5.589 0.485 0.848 25 14 Strong" 27 1 27 72 parsed_7jgx 1
9 "9 A -66.135 -39.467 4.481 4.737 0.542 0.864 25 15 Strong" 31 1 31 72 parsed_7jgx 1
10 "10 D -64.987 -40.392 4.243 6.453 0.585 0.879 25 15 Strong" 35 1 35 72 parsed_7jgx 1
11 "11 V -63.996 -35.497 6.394 3.671 0.830 0.869 25 15 Strong" 39 1 39 72 parsed_7jgx 1
stop_
save_