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 |
|
|
504734 |
2emx   |
10226 | cing | 2-parsed | STAR | dihedral angle | 42 |
data_2emx_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2emx
_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_2emx 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2emx
_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 2emx "Master copy" parsed_2emx
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2emx
_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 2emx.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2emx 1
1 2emx.mr . . DYANA/DIANA 2 distance "general distance" simple 12 parsed_2emx 1
1 2emx.mr . . DYANA/DIANA 3 distance "general distance" simple 12 parsed_2emx 1
1 2emx.mr . . DYANA/DIANA 4 distance NOE simple 496 parsed_2emx 1
1 2emx.mr . . DYANA/DIANA 5 "dihedral angle" "Not applicable" "Not applicable" 42 parsed_2emx 1
1 2emx.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2emx 1
stop_
save_
save_DYANA/DIANA_dihedral_5
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2emx
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 5
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 13 CYSS . . . . . . . . . . . . . parsed_2emx 1
2 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . . 16 CYSS . . . . . . . . . . . . . parsed_2emx 1
3 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . . 29 HIS . . . . . . . . . . . . . parsed_2emx 1
4 CHI1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . . 33 HIS . . . . . . . . . . . . . parsed_2emx 1
5 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -137.0 -77.0 . . 11 PHE . . . . . . . . . . . . . parsed_2emx 1
6 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 99.0 159.0 . . 11 PHE . . . . . . . . . . . . . parsed_2emx 1
7 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -132.0 -72.0 . . 12 GLY . . . . . . . . . . . . . parsed_2emx 1
8 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 96.0 156.0 . . 12 GLY . . . . . . . . . . . . . parsed_2emx 1
9 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -113.0 -53.0 . . 14 SER . . . . . . . . . . . . . parsed_2emx 1
10 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.0 4.0 . . 14 SER . . . . . . . . . . . . . parsed_2emx 1
11 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -130.0 -70.0 . . 15 CYS . . . . . . . . . . . . . parsed_2emx 1
12 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -45.0 15.0 . . 15 CYS . . . . . . . . . . . . . parsed_2emx 1
13 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.0 -59.0 . . 17 GLU . . . . . . . . . . . . . parsed_2emx 1
14 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -31.0 29.0 . . 17 GLU . . . . . . . . . . . . . parsed_2emx 1
15 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.0 -52.0 . . 18 LYS . . . . . . . . . . . . . parsed_2emx 1
16 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.0 180.0 . . 18 LYS . . . . . . . . . . . . . parsed_2emx 1
17 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.0 -95.0 . . 19 ALA . . . . . . . . . . . . . parsed_2emx 1
18 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114.0 174.0 . . 19 ALA . . . . . . . . . . . . . parsed_2emx 1
19 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -156.0 -96.0 . . 20 PHE . . . . . . . . . . . . . parsed_2emx 1
20 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.0 182.0 . . 20 PHE . . . . . . . . . . . . . parsed_2emx 1
21 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.0 -34.0 . . 24 SER . . . . . . . . . . . . . parsed_2emx 1
22 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 24 SER . . . . . . . . . . . . . parsed_2emx 1
23 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.0 -38.0 . . 25 TYR . . . . . . . . . . . . . parsed_2emx 1
24 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -65.0 -5.0 . . 25 TYR . . . . . . . . . . . . . parsed_2emx 1
25 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . . 26 LEU . . . . . . . . . . . . . parsed_2emx 1
26 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.0 -11.0 . . 26 LEU . . . . . . . . . . . . . parsed_2emx 1
27 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.0 -34.0 . . 27 LEU . . . . . . . . . . . . . parsed_2emx 1
28 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.0 -7.0 . . 27 LEU . . . . . . . . . . . . . parsed_2emx 1
29 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.0 -36.0 . . 28 VAL . . . . . . . . . . . . . parsed_2emx 1
30 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.0 -13.0 . . 28 VAL . . . . . . . . . . . . . parsed_2emx 1
31 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.0 -34.0 . . 29 HIS . . . . . . . . . . . . . parsed_2emx 1
32 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.0 -9.0 . . 29 HIS . . . . . . . . . . . . . parsed_2emx 1
33 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -95.0 -35.0 . . 30 GLN . . . . . . . . . . . . . parsed_2emx 1
34 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.0 -10.0 . . 30 GLN . . . . . . . . . . . . . parsed_2emx 1
35 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -98.0 -38.0 . . 31 GLN . . . . . . . . . . . . . parsed_2emx 1
36 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.0 -4.0 . . 31 GLN . . . . . . . . . . . . . parsed_2emx 1
37 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -40.0 . . 32 THR . . . . . . . . . . . . . parsed_2emx 1
38 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -59.0 1.0 . . 32 THR . . . . . . . . . . . . . parsed_2emx 1
39 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.0 -59.0 . . 33 HIS . . . . . . . . . . . . . parsed_2emx 1
40 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.0 20.0 . . 33 HIS . . . . . . . . . . . . . parsed_2emx 1
41 PHI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -110.0 -50.0 . . 34 ALA . . . . . . . . . . . . . parsed_2emx 1
42 PSI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -40.0 20.0 . . 34 ALA . . . . . . . . . . . . . parsed_2emx 1
stop_
save_
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