NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
31654 |
1ery   |
cing | 2-parsed | STAR | dihedral angle | 40 |
data_1ery_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1ery
_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_1ery 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1ery
_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 1ery "Master copy" parsed_1ery
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1ery
_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 1ery.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1ery 1
1 1ery.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1ery 1
1 1ery.mr . . n/a 3 "chemical shift" "Not applicable" "format 1" 0 parsed_1ery 1
1 1ery.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1ery 1
1 1ery.mr . . DYANA/DIANA 5 distance NOE simple 449 parsed_1ery 1
1 1ery.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1ery 1
1 1ery.mr . . DYANA/DIANA 7 "dihedral angle" "Not applicable" "Not applicable" 40 parsed_1ery 1
1 1ery.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1ery 1
1 1ery.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1ery 1
stop_
save_
save_DYANA/DIANA_dihedral_7
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1ery
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 7
_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 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 25.0 245.0 . . 1 ASP- . . . . . . . . . . . . . parsed_1ery 1
2 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -175.0 -45.0 . . 2 GLU- . . . . . . . . . . . . . parsed_1ery 1
3 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 155.0 325.0 . . 2 GLU- . . . . . . . . . . . . . parsed_1ery 1
4 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -55.0 . . 3 CYSS . . . . . . . . . . . . . parsed_1ery 1
5 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.0 185.0 . . 3 CYSS . . . . . . . . . . . . . parsed_1ery 1
6 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 35.0 325.0 . . 4 ALA . . . . . . . . . . . . . parsed_1ery 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 45.0 315.0 . . 5 ASN . . . . . . . . . . . . . parsed_1ery 1
8 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 195.0 . . 6 ALA . . . . . . . . . . . . . parsed_1ery 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 45.0 315.0 . . 7 ALA . . . . . . . . . . . . . parsed_1ery 1
10 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 35.0 315.0 . . 8 ALA . . . . . . . . . . . . . parsed_1ery 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -135.0 -75.0 . . 9 GLN . . . . . . . . . . . . . parsed_1ery 1
12 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 215.0 . . 9 GLN . . . . . . . . . . . . . parsed_1ery 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 35.0 95.0 . . 10 CYSS . . . . . . . . . . . . . parsed_1ery 1
14 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -265.0 25.0 . . 10 CYSS . . . . . . . . . . . . . parsed_1ery 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.0 -95.0 . . 11 SER . . . . . . . . . . . . . parsed_1ery 1
16 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.0 185.0 . . 11 SER . . . . . . . . . . . . . parsed_1ery 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -165.0 -75.0 . . 13 THR . . . . . . . . . . . . . parsed_1ery 1
18 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -75.0 -35.0 . . 14 LEU . . . . . . . . . . . . . parsed_1ery 1
19 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 155.0 315.0 . . 14 LEU . . . . . . . . . . . . . parsed_1ery 1
20 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 315.0 . . 15 CYSS . . . . . . . . . . . . . parsed_1ery 1
21 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.0 345.0 . . 15 CYSS . . . . . . . . . . . . . parsed_1ery 1
22 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 35.0 325.0 . . 16 ASN . . . . . . . . . . . . . parsed_1ery 1
23 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 165.0 . . 16 ASN . . . . . . . . . . . . . parsed_1ery 1
24 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 17 LEU . . . . . . . . . . . . . parsed_1ery 1
25 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 155.0 325.0 . . 18 TYR . . . . . . . . . . . . . parsed_1ery 1
26 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 155.0 325.0 . . 19 CYSS . . . . . . . . . . . . . parsed_1ery 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 23 ILE . . . . . . . . . . . . . parsed_1ery 1
28 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 85.0 325.0 . . 24 GLU- . . . . . . . . . . . . . parsed_1ery 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.0 -55.0 . . 25 ILE . . . . . . . . . . . . . parsed_1ery 1
30 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -55.0 . . 26 CYSS . . . . . . . . . . . . . parsed_1ery 1
31 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 165.0 215.0 . . 26 CYSS . . . . . . . . . . . . . parsed_1ery 1
32 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 27 GLU- . . . . . . . . . . . . . parsed_1ery 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 35.0 315.0 . . 29 THR . . . . . . . . . . . . . parsed_1ery 1
34 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 -45.0 . . 30 VAL . . . . . . . . . . . . . parsed_1ery 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -85.0 45.0 . . 31 MET . . . . . . . . . . . . . parsed_1ery 1
36 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -55.0 . . 32 GLN . . . . . . . . . . . . . parsed_1ery 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 33 ASN . . . . . . . . . . . . . parsed_1ery 1
38 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -85.0 . . 34 CYSS . . . . . . . . . . . . . parsed_1ery 1
39 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 145.0 185.0 . . 38 PHE . . . . . . . . . . . . . parsed_1ery 1
40 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -145.0 55.0 . . 39 SER . . . . . . . . . . . . . parsed_1ery 1
stop_
save_
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