NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
636148 |
6gnz   |
34278 | cing | 2-parsed | STAR | dihedral angle | 44 |
data_6gnz_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6gnz
_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_6gnz 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6gnz
_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 6gnz "Master copy" parsed_6gnz
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6gnz
_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 6gnz.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6gnz 1
1 6gnz.mr . . DYANA/DIANA 2 distance NOE simple 432 parsed_6gnz 1
1 6gnz.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 44 parsed_6gnz 1
1 6gnz.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6gnz 1
stop_
save_
save_DYANA/DIANA_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_6gnz
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.2 -50.4 . . 5 ALA . . . . . . . . . . . . . parsed_6gnz 1
2 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -63.6 -16.2 . . 5 ALA . . . . . . . . . . . . . parsed_6gnz 1
3 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.1 -43.0 . . 6 TYR . . . . . . . . . . . . . parsed_6gnz 1
4 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -68.1 -9.6 . . 6 TYR . . . . . . . . . . . . . parsed_6gnz 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.7 -54.7 . . 7 ASN . . . . . . . . . . . . . parsed_6gnz 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.2 -16.4 . . 7 ASN . . . . . . . . . . . . . parsed_6gnz 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -55.0 . . 8 MET . . . . . . . . . . . . . parsed_6gnz 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.6 -15.7 . . 8 MET . . . . . . . . . . . . . parsed_6gnz 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.3 -46.9 . . 9 GLY . . . . . . . . . . . . . parsed_6gnz 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.5 -29.3 . . 9 GLY . . . . . . . . . . . . . parsed_6gnz 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.7 -51.7 . . 10 HIS . . . . . . . . . . . . . parsed_6gnz 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.9 -30.8 . . 10 HIS . . . . . . . . . . . . . parsed_6gnz 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -72.9 -52.9 . . 11 TYR . . . . . . . . . . . . . parsed_6gnz 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.5 -29.5 . . 11 TYR . . . . . . . . . . . . . parsed_6gnz 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.5 -56.5 . . 12 ALA . . . . . . . . . . . . . parsed_6gnz 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.5 -28.0 . . 12 ALA . . . . . . . . . . . . . parsed_6gnz 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.1 -49.9 . . 13 GLY . . . . . . . . . . . . . parsed_6gnz 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.7 -27.3 . . 13 GLY . . . . . . . . . . . . . parsed_6gnz 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.7 -54.7 . . 14 LYS . . . . . . . . . . . . . parsed_6gnz 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.3 -30.3 . . 14 LYS . . . . . . . . . . . . . parsed_6gnz 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.4 -49.6 . . 15 ALA . . . . . . . . . . . . . parsed_6gnz 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.4 -27.8 . . 15 ALA . . . . . . . . . . . . . parsed_6gnz 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.8 -54.3 . . 16 THR . . . . . . . . . . . . . parsed_6gnz 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.3 -32.1 . . 16 THR . . . . . . . . . . . . . parsed_6gnz 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.5 -50.1 . . 17 ILE . . . . . . . . . . . . . parsed_6gnz 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.0 -32.9 . . 17 ILE . . . . . . . . . . . . . parsed_6gnz 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.9 -53.8 . . 18 PHE . . . . . . . . . . . . . parsed_6gnz 1
28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -61.9 -1.8 . . 18 PHE . . . . . . . . . . . . . parsed_6gnz 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.9 -39.9 . . 19 GLY . . . . . . . . . . . . . parsed_6gnz 1
30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.8 -20.5 . . 19 GLY . . . . . . . . . . . . . parsed_6gnz 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.2 -55.2 . . 20 LEU . . . . . . . . . . . . . parsed_6gnz 1
32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.1 -31.1 . . 20 LEU . . . . . . . . . . . . . parsed_6gnz 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.7 -51.5 . . 21 ALA . . . . . . . . . . . . . parsed_6gnz 1
34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.9 -26.5 . . 21 ALA . . . . . . . . . . . . . parsed_6gnz 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.4 -54.1 . . 22 ALA . . . . . . . . . . . . . parsed_6gnz 1
36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.9 -32.9 . . 22 ALA . . . . . . . . . . . . . parsed_6gnz 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -89.4 -44.7 . . 23 TRP . . . . . . . . . . . . . parsed_6gnz 1
38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.1 -18.6 . . 23 TRP . . . . . . . . . . . . . parsed_6gnz 1
39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -74.9 -52.5 . . 24 ALA . . . . . . . . . . . . . parsed_6gnz 1
40 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -60.5 -15.7 . . 24 ALA . . . . . . . . . . . . . parsed_6gnz 1
41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -79.8 -57.5 . . 25 LEU . . . . . . . . . . . . . parsed_6gnz 1
42 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -58.7 -12.7 . . 25 LEU . . . . . . . . . . . . . parsed_6gnz 1
43 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -109.3 -36.5 . . 26 LEU . . . . . . . . . . . . . parsed_6gnz 1
44 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -57.7 -13.4 . . 26 LEU . . . . . . . . . . . . . parsed_6gnz 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 2: talos2.aco" 1 1 1 31 parsed_6gnz 1
stop_
save_
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