Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
530010 | 4a54 RC | 18042 | cing | 2-parsed | STAR | dihedral angle | 62 |
data_4a54_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_4a54
_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_4a54 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_4a54
_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 4a54 "Master copy" parsed_4a54
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_4a54
_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 4a54.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_4a54 1
1 4a54.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 134 parsed_4a54 1
1 4a54.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 44 parsed_4a54 1
1 4a54.mr . . XPLOR/CNS 4 distance NOE simple 66 parsed_4a54 1
1 4a54.mr . . XPLOR/CNS 5 "coupling constant" "Not applicable" "Not applicable" 0 parsed_4a54 1
1 4a54.mr . . XPLOR/CNS 6 distance NOE simple 47 parsed_4a54 1
1 4a54.mr . . unknown 7 distance "hydrogen bond" simple 0 parsed_4a54 1
1 4a54.mr . . XPLOR/CNS 8 distance NOE simple 128 parsed_4a54 1
1 4a54.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 62 parsed_4a54 1
1 4a54.mr . . XPLOR/CNS 10 distance NOE simple 0 parsed_4a54 1
1 4a54.mr . . "MR format" 11 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_4a54 1
stop_
save_
save_CNS/XPLOR_dihedral_9
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_4a54
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 9
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 90.0 . B 253 . n B 253 . ca B 253 . cb B 253 . cg parsed_4a54 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 260 . n B 260 . ca B 260 . cb B 260 . cg parsed_4a54 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 260 . ca B 260 . cb B 260 . cg B 260 . cd1 parsed_4a54 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 261 . n B 261 . ca B 261 . cb B 261 . cg parsed_4a54 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . B 261 . ca B 261 . cb B 261 . cg B 261 . cd1 parsed_4a54 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 263 . n B 263 . ca B 263 . cb B 263 . cg parsed_4a54 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 263 . ca B 263 . cb B 263 . cg B 263 . cd1 parsed_4a54 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . B 264 . n B 264 . ca B 264 . cb B 264 . cg parsed_4a54 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . B 264 . ca B 264 . cb B 264 . cg B 264 . cd1 parsed_4a54 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 2 . n A 2 . ca A 2 . cb A 2 . og parsed_4a54 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 3 . n A 3 . ca A 3 . cb A 3 . cg1 parsed_4a54 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 5 . n A 5 . ca A 5 . cb A 5 . cg parsed_4a54 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 6 . n A 6 . ca A 6 . cb A 6 . cg parsed_4a54 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 2 . n A 2 . ca A 2 . cb A 2 . og parsed_4a54 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 11 . n A 11 . ca A 11 . cb A 11 . cg1 parsed_4a54 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 12 . n A 12 . ca A 12 . cb A 12 . cg parsed_4a54 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 13 . n A 13 . ca A 13 . cb A 13 . cg1 parsed_4a54 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 14 . n A 14 . ca A 14 . cb A 14 . cg parsed_4a54 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 14 . ca A 14 . cb A 14 . cg A 14 . cd1 parsed_4a54 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 15 . n A 15 . ca A 15 . cb A 15 . cg parsed_4a54 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 15 . ca A 15 . cb A 15 . cg A 15 . cd1 parsed_4a54 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 16 . n A 16 . ca A 16 . cb A 16 . cg parsed_4a54 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 17 . n A 17 . ca A 17 . cb A 17 . cg parsed_4a54 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 90.0 . A 18 . n A 18 . ca A 18 . cb A 18 . cg parsed_4a54 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 19 . n A 19 . ca A 19 . cb A 19 . og parsed_4a54 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60.0 60.0 . A 22 . n A 22 . ca A 22 . cb A 22 . cg parsed_4a54 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 24 . n A 24 . ca A 24 . cb A 24 . cg1 parsed_4a54 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 25 . n A 25 . ca A 25 . cb A 25 . cg1 parsed_4a54 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 25 . ca A 25 . cb A 25 . cg1 A 25 . cd1 parsed_4a54 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30 90 . A 26 . n A 26 . ca A 26 . cb A 26 . og1 parsed_4a54 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 27 . n A 27 . ca A 27 . cb A 27 . cg parsed_4a54 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 28 . n A 28 . ca A 28 . cb A 28 . cg parsed_4a54 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 29 . n A 29 . ca A 29 . cb A 29 . cg parsed_4a54 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 32 . n A 32 . ca A 32 . cb A 32 . cg parsed_4a54 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 90.0 . A 33 . n A 33 . ca A 33 . cb A 33 . og parsed_4a54 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 34 . n A 34 . ca A 34 . cb A 34 . cg1 parsed_4a54 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 34 . ca A 34 . cb A 34 . cg1 A 34 . cd1 parsed_4a54 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 35 . n A 35 . ca A 35 . cb A 35 . cg parsed_4a54 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 35 . ca A 35 . cb A 35 . cg A 35 . cd1 parsed_4a54 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 36 . n A 36 . ca A 36 . cb A 36 . cg parsed_4a54 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 37 . n A 37 . ca A 37 . cb A 37 . cg parsed_4a54 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 37 . ca A 37 . cb A 37 . cg A 37 . cd1 parsed_4a54 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 39 . n A 39 . ca A 39 . cb A 39 . cg parsed_4a54 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 39 . ca A 39 . cb A 39 . cg A 39 . cd1 parsed_4a54 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 43 . n A 43 . ca A 43 . cb A 43 . og parsed_4a54 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 44 . n A 44 . ca A 44 . cb A 44 . og1 parsed_4a54 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 46 . n A 46 . ca A 46 . cb A 46 . og parsed_4a54 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 47 . n A 47 . ca A 47 . cb A 47 . cg1 parsed_4a54 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 47 . ca A 47 . cb A 47 . cg1 A 47 . cd1 parsed_4a54 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 48 . n A 48 . ca A 48 . cb A 48 . cg1 parsed_4a54 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 49 . n A 49 . ca A 49 . cb A 49 . og1 parsed_4a54 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 51 . n A 51 . ca A 51 . cb A 51 . cg parsed_4a54 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 52 . n A 52 . ca A 52 . cb A 52 . cg1 parsed_4a54 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 52 . ca A 52 . cb A 52 . cg1 A 52 . cd1 parsed_4a54 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 53 . n A 53 . ca A 53 . cb A 53 . cg parsed_4a54 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 54 . n A 54 . ca A 54 . cb A 54 . cg parsed_4a54 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 55 . n A 55 . ca A 55 . cb A 55 . cg parsed_4a54 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 30.0 90.0 . A 56 . n A 56 . ca A 56 . cb A 56 . cg parsed_4a54 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 57 . n A 57 . ca A 57 . cb A 57 . cg1 parsed_4a54 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 57 . ca A 57 . cb A 57 . cg1 A 57 . cd1 parsed_4a54 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -30.0 . A 58 . n A 58 . ca A 58 . cb A 58 . cg parsed_4a54 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 150.0 210.0 . A 58 . ca A 58 . cb A 58 . cg A 58 . cd1 parsed_4a54 1
stop_
save_