NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
612701 |
5t0x   |
30156 | cing | 2-parsed | STAR | dihedral angle | 79 |
data_5t0x_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5t0x
_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_5t0x 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5t0x
_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 5t0x "Master copy" parsed_5t0x
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5t0x
_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 5t0x.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5t0x 1
1 5t0x.mr . . XPLOR/CNS 2 distance NOE simple 126 parsed_5t0x 1
1 5t0x.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 79 parsed_5t0x 1
1 5t0x.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_5t0x 1
1 5t0x.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5t0x 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_5t0x
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 288 . C B 289 . N B 289 . CA B 289 . C parsed_5t0x 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 289 . C B 290 . N B 290 . CA B 290 . C parsed_5t0x 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 290 . C B 291 . N B 291 . CA B 291 . C parsed_5t0x 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 291 . C B 292 . N B 292 . CA B 292 . C parsed_5t0x 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 292 . C B 293 . N B 293 . CA B 293 . C parsed_5t0x 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 293 . C B 294 . N B 294 . CA B 294 . C parsed_5t0x 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 294 . C B 295 . N B 295 . CA B 295 . C parsed_5t0x 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 295 . C B 296 . N B 296 . CA B 296 . C parsed_5t0x 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 296 . C B 297 . N B 297 . CA B 297 . C parsed_5t0x 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 297 . C B 298 . N B 298 . CA B 298 . C parsed_5t0x 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 298 . C B 299 . N B 299 . CA B 299 . C parsed_5t0x 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 299 . C B 300 . N B 300 . CA B 300 . C parsed_5t0x 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 300 . C B 301 . N B 301 . CA B 301 . C parsed_5t0x 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 301 . C B 302 . N B 302 . CA B 302 . C parsed_5t0x 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 302 . C B 303 . N B 303 . CA B 303 . C parsed_5t0x 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 303 . C B 304 . N B 304 . CA B 304 . C parsed_5t0x 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . B 304 . C B 305 . N B 305 . CA B 305 . C parsed_5t0x 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 288 . N B 288 . CA B 288 . C B 289 . N parsed_5t0x 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 289 . N B 289 . CA B 289 . C B 290 . N parsed_5t0x 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 290 . N B 290 . CA B 290 . C B 291 . N parsed_5t0x 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 291 . N B 291 . CA B 291 . C B 292 . N parsed_5t0x 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 292 . N B 292 . CA B 292 . C B 293 . N parsed_5t0x 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 293 . N B 293 . CA B 293 . C B 294 . N parsed_5t0x 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 294 . N B 294 . CA B 294 . C B 295 . N parsed_5t0x 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 295 . N B 295 . CA B 295 . C B 296 . N parsed_5t0x 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 296 . N B 296 . CA B 296 . C B 297 . N parsed_5t0x 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 297 . N B 297 . CA B 297 . C B 298 . N parsed_5t0x 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 298 . N B 298 . CA B 298 . C B 299 . N parsed_5t0x 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 299 . N B 299 . CA B 299 . C B 300 . N parsed_5t0x 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 300 . N B 300 . CA B 300 . C B 301 . N parsed_5t0x 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 301 . N B 301 . CA B 301 . C B 302 . N parsed_5t0x 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 302 . N B 302 . CA B 302 . C B 303 . N parsed_5t0x 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 303 . N B 303 . CA B 303 . C B 304 . N parsed_5t0x 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . B 304 . N B 304 . CA B 304 . C B 305 . N parsed_5t0x 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 288 . C C 289 . N C 289 . CA C 289 . C parsed_5t0x 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 289 . C C 290 . N C 290 . CA C 290 . C parsed_5t0x 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 290 . C C 291 . N C 291 . CA C 291 . C parsed_5t0x 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 291 . C C 292 . N C 292 . CA C 292 . C parsed_5t0x 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 292 . C C 293 . N C 293 . CA C 293 . C parsed_5t0x 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 293 . C C 294 . N C 294 . CA C 294 . C parsed_5t0x 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 294 . C C 295 . N C 295 . CA C 295 . C parsed_5t0x 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 295 . C C 296 . N C 296 . CA C 296 . C parsed_5t0x 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 296 . C C 297 . N C 297 . CA C 297 . C parsed_5t0x 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 297 . C C 298 . N C 298 . CA C 298 . C parsed_5t0x 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 298 . C C 299 . N C 299 . CA C 299 . C parsed_5t0x 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 299 . C C 300 . N C 300 . CA C 300 . C parsed_5t0x 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 300 . C C 301 . N C 301 . CA C 301 . C parsed_5t0x 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 301 . C C 302 . N C 302 . CA C 302 . C parsed_5t0x 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 302 . C C 303 . N C 303 . CA C 303 . C parsed_5t0x 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 303 . C C 304 . N C 304 . CA C 304 . C parsed_5t0x 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . C 304 . C C 305 . N C 305 . CA C 305 . C parsed_5t0x 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 288 . N C 288 . CA C 288 . C C 289 . N parsed_5t0x 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 289 . N C 289 . CA C 289 . C C 290 . N parsed_5t0x 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 290 . N C 290 . CA C 290 . C C 291 . N parsed_5t0x 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 291 . N C 291 . CA C 291 . C C 292 . N parsed_5t0x 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 292 . N C 292 . CA C 292 . C C 293 . N parsed_5t0x 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 293 . N C 293 . CA C 293 . C C 294 . N parsed_5t0x 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 294 . N C 294 . CA C 294 . C C 295 . N parsed_5t0x 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 295 . N C 295 . CA C 295 . C C 296 . N parsed_5t0x 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 296 . N C 296 . CA C 296 . C C 297 . N parsed_5t0x 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 297 . N C 297 . CA C 297 . C C 298 . N parsed_5t0x 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 298 . N C 298 . CA C 298 . C C 299 . N parsed_5t0x 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 299 . N C 299 . CA C 299 . C C 300 . N parsed_5t0x 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 300 . N C 300 . CA C 300 . C C 301 . N parsed_5t0x 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 301 . N C 301 . CA C 301 . C C 302 . N parsed_5t0x 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 302 . N C 302 . CA C 302 . C C 303 . N parsed_5t0x 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 303 . N C 303 . CA C 303 . C C 304 . N parsed_5t0x 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 304 . N C 304 . CA C 304 . C C 305 . N parsed_5t0x 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . A 81 . C A 82 . N A 82 . CA A 82 . C parsed_5t0x 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . A 82 . C A 83 . N A 83 . CA A 83 . C parsed_5t0x 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . A 83 . C A 84 . N A 84 . CA A 84 . C parsed_5t0x 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . A 84 . C A 85 . N A 85 . CA A 85 . C parsed_5t0x 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . A 85 . C A 86 . N A 86 . CA A 86 . C parsed_5t0x 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.00 -30.00 . A 86 . C A 87 . N A 87 . CA A 87 . C parsed_5t0x 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 82 . N C 82 . CA C 82 . C C 83 . N parsed_5t0x 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 83 . N C 83 . CA C 83 . C C 84 . N parsed_5t0x 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 84 . N C 84 . CA C 84 . C C 85 . N parsed_5t0x 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 85 . N C 85 . CA C 85 . C C 86 . N parsed_5t0x 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -70.00 -10.00 . C 86 . N C 86 . CA C 86 . C C 87 . N parsed_5t0x 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 "!!phi_dihed.tbl (ER287N.pdb)" 1 1 1 30 parsed_5t0x 1
2 "!!psi_dihed.tbl (ER287N.pdb)" 56 1 56 30 parsed_5t0x 1
3 "!!phi_dihed.tbl (ER287C.pdb)" 110 1 110 30 parsed_5t0x 1
4 "!!psi_dihed.tbl (ER287C.pdb)" 165 1 165 30 parsed_5t0x 1
5 "!!phi_dihed.tbl (cam.pdb)" 220 1 220 27 parsed_5t0x 1
6 "!!psi_dihed.tbl (cam.pdb)" 239 1 239 27 parsed_5t0x 1
stop_
save_
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