NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | in_dress | stage | program | type | item_count |
|
|
30758 |
1d8z   |
cing | recoord | dress | 2-parsed | STAR | dihedral angle | 85 |
data_1d8z_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1d8z
_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_1d8z 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1d8z
_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 1d8z "Master copy" parsed_1d8z
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1d8z
_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 1d8z.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1d8z 1
1 1d8z.mr . . XPLOR/CNS 2 distance NOE simple 603 parsed_1d8z 1
1 1d8z.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 58 parsed_1d8z 1
1 1d8z.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 85 parsed_1d8z 1
1 1d8z.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1d8z 1
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_1d8z
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 6 . c . 7 . n . 7 . ca . 7 . c parsed_1d8z 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 7 . c . 8 . n . 8 . ca . 8 . c parsed_1d8z 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 8 . c . 9 . n . 9 . ca . 9 . c parsed_1d8z 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 15 . c . 16 . n . 16 . ca . 16 . c parsed_1d8z 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 36 . c . 37 . n . 37 . ca . 37 . c parsed_1d8z 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 39 . c . 40 . n . 40 . ca . 40 . c parsed_1d8z 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 44 . c . 45 . n . 45 . ca . 45 . c parsed_1d8z 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 48 . c . 49 . n . 49 . ca . 49 . c parsed_1d8z 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 49 . c . 50 . n . 50 . ca . 50 . c parsed_1d8z 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 50 . c . 51 . n . 51 . ca . 51 . c parsed_1d8z 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 51 . c . 52 . n . 52 . ca . 52 . c parsed_1d8z 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 63 . c . 64 . n . 64 . ca . 64 . c parsed_1d8z 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 64 . c . 65 . n . 65 . ca . 65 . c parsed_1d8z 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 80.0 160.0 . . 66 . c . 67 . n . 67 . ca . 67 . c parsed_1d8z 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 69 . c . 70 . n . 70 . ca . 70 . c parsed_1d8z 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 72 . c . 73 . n . 73 . ca . 73 . c parsed_1d8z 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 73 . c . 74 . n . 74 . ca . 74 . c parsed_1d8z 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 76 . c . 77 . n . 77 . ca . 77 . c parsed_1d8z 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -160.0 -80.0 . . 77 . c . 78 . n . 78 . ca . 78 . c parsed_1d8z 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 12 . c . 13 . n . 13 . ca . 13 . c parsed_1d8z 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 14 . c . 15 . n . 15 . ca . 15 . c parsed_1d8z 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 18 . c . 19 . n . 19 . ca . 19 . c parsed_1d8z 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 19 . c . 20 . n . 20 . ca . 20 . c parsed_1d8z 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 21 . c . 22 . n . 22 . ca . 22 . c parsed_1d8z 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 22 . c . 23 . n . 23 . ca . 23 . c parsed_1d8z 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 23 . c . 24 . n . 24 . ca . 24 . c parsed_1d8z 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 25 . c . 26 . n . 26 . ca . 26 . c parsed_1d8z 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 28 . c . 29 . n . 29 . ca . 29 . c parsed_1d8z 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 37 . c . 38 . n . 38 . ca . 38 . c parsed_1d8z 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 52 . c . 53 . n . 53 . ca . 53 . c parsed_1d8z 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 57 . c . 58 . n . 58 . ca . 58 . c parsed_1d8z 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 58 . c . 59 . n . 59 . ca . 59 . c parsed_1d8z 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 59 . c . 60 . n . 60 . ca . 60 . c parsed_1d8z 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 60 . c . 61 . n . 61 . ca . 61 . c parsed_1d8z 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 62 . c . 63 . n . 63 . ca . 63 . c parsed_1d8z 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 65 . c . 66 . n . 66 . ca . 66 . c parsed_1d8z 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 67 . c . 68 . n . 68 . ca . 68 . c parsed_1d8z 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 68 . c . 69 . n . 69 . ca . 69 . c parsed_1d8z 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -90.0 -40.0 . . 78 . c . 79 . n . 79 . ca . 79 . c parsed_1d8z 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 1 . n . 1 . ca . 1 . cb . 1 . cg parsed_1d8z 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 5 . n . 5 . ca . 5 . cb . 5 . cg parsed_1d8z 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 14 . n . 14 . ca . 14 . cb . 14 . cg parsed_1d8z 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 18 . n . 18 . ca . 18 . cb . 18 . cg parsed_1d8z 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 59 . n . 59 . ca . 59 . cb . 59 . cg parsed_1d8z 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 6 . n . 6 . ca . 6 . cb . 6 . cg parsed_1d8z 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 10 . n . 10 . ca . 10 . cb . 10 . cg parsed_1d8z 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 11 . n . 11 . ca . 11 . cb . 11 . cg parsed_1d8z 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 24 . n . 24 . ca . 24 . cb . 24 . cg parsed_1d8z 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 33 . n . 33 . ca . 33 . cb . 33 . sg parsed_1d8z 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 45 . n . 45 . ca . 45 . cb . 45 . cg parsed_1d8z 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 49 . n . 49 . ca . 49 . cb . 49 . cg parsed_1d8z 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 52 . n . 52 . ca . 52 . cb . 52 . cg parsed_1d8z 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 65 . n . 65 . ca . 65 . cb . 65 . cg parsed_1d8z 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 68 . n . 68 . ca . 68 . cb . 68 . cg parsed_1d8z 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 70 . n . 70 . ca . 70 . cb . 70 . cg parsed_1d8z 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 73 . n . 73 . ca . 73 . cb . 73 . cg parsed_1d8z 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 79 . n . 79 . ca . 79 . cb . 79 . cg parsed_1d8z 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 2 . n . 2 . ca . 2 . cb . 2 . og parsed_1d8z 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 15 . n . 15 . ca . 15 . cb . 15 . cg parsed_1d8z 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 20 . n . 20 . ca . 20 . cb . 20 . cg parsed_1d8z 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 21 . n . 21 . ca . 21 . cb . 21 . cg parsed_1d8z 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 23 . n . 23 . ca . 23 . cb . 23 . cg parsed_1d8z 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 35 . n . 35 . ca . 35 . cb . 35 . cg parsed_1d8z 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 8 . n . 8 . ca . 8 . cb . 8 . cg2 parsed_1d8z 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 36 . n . 36 . ca . 36 . cb . 36 . cg2 parsed_1d8z 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 50 . n . 50 . ca . 50 . cb . 50 . cg2 parsed_1d8z 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 77 . n . 77 . ca . 77 . cb . 77 . cg2 parsed_1d8z 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 7 . n . 7 . ca . 7 . cb . 7 . cg1 parsed_1d8z 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 27 . n . 27 . ca . 27 . cb . 27 . cg1 parsed_1d8z 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 30 . n . 30 . ca . 30 . cb . 30 . cg1 parsed_1d8z 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -80.0 -40.0 . . 62 . n . 62 . ca . 62 . cb . 62 . cg1 parsed_1d8z 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 16 . n . 16 . ca . 16 . cb . 16 . og1 parsed_1d8z 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 160.0 200.0 . . 41 . n . 41 . ca . 41 . cb . 41 . og1 parsed_1d8z 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 40.0 80.0 . . 72 . n . 72 . ca . 72 . cb . 72 . og1 parsed_1d8z 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 6 . ca . 6 . cb . 6 . cg . 6 . cd1 parsed_1d8z 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 11 . ca . 11 . cb . 11 . cg . 11 . cd1 parsed_1d8z 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 23 . ca . 23 . cb . 23 . cg . 23 . cd1 parsed_1d8z 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 35 . ca . 35 . cb . 35 . cg . 35 . cd1 parsed_1d8z 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 45 . ca . 45 . cb . 45 . cg . 45 . cd1 parsed_1d8z 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 68 . ca . 68 . cb . 68 . cg . 68 . cd1 parsed_1d8z 1
81 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 70 . ca . 70 . cb . 70 . cg . 70 . cd1 parsed_1d8z 1
82 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 7 . cg2 . 7 . cb . 7 . cg1 . 7 . cd1 parsed_1d8z 1
83 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 27 . cg2 . 27 . cb . 27 . cg1 . 27 . cd1 parsed_1d8z 1
84 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -100.0 -20.0 . . 30 . cg2 . 30 . cb . 30 . cg1 . 30 . cd1 parsed_1d8z 1
85 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 140.0 220.0 . . 15 . ca . 15 . cb . 15 . cg . 15 . sd parsed_1d8z 1
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