NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
555862 |
2m0a   |
18587 | cing | 2-parsed | STAR | dipolar coupling | 45 |
data_2m0a_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2m0a
_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_2m0a 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2m0a
_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 2m0a "Master copy" parsed_2m0a
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2m0a
_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 2m0a.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2m0a 1
1 2m0a.mr . . XPLOR/CNS 2 distance NOE simple 943 parsed_2m0a 1
1 2m0a.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 160 parsed_2m0a 1
1 2m0a.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 45 parsed_2m0a 1
1 2m0a.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 0 parsed_2m0a 1
1 2m0a.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2m0a 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2m0a
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 4
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint.ID
_RDC_constraint.Assembly_atom_ID_1
_RDC_constraint.Entity_assembly_ID_1
_RDC_constraint.Entity_ID_1
_RDC_constraint.Comp_index_ID_1
_RDC_constraint.Seq_ID_1
_RDC_constraint.Comp_ID_1
_RDC_constraint.Atom_ID_1
_RDC_constraint.Resonance_ID_1
_RDC_constraint.Assembly_atom_ID_2
_RDC_constraint.Entity_assembly_ID_2
_RDC_constraint.Entity_ID_2
_RDC_constraint.Comp_index_ID_2
_RDC_constraint.Seq_ID_2
_RDC_constraint.Comp_ID_2
_RDC_constraint.Atom_ID_2
_RDC_constraint.Resonance_ID_2
_RDC_constraint.RDC_val
_RDC_constraint.RDC_lower_bound
_RDC_constraint.RDC_upper_bound
_RDC_constraint.RDC_val_err
_RDC_constraint.Source_experiment_ID
_RDC_constraint.Auth_asym_ID_1
_RDC_constraint.Auth_seq_ID_1
_RDC_constraint.Auth_comp_ID_1
_RDC_constraint.Auth_atom_ID_1
_RDC_constraint.Auth_asym_ID_2
_RDC_constraint.Auth_seq_ID_2
_RDC_constraint.Auth_comp_ID_2
_RDC_constraint.Auth_atom_ID_2
_RDC_constraint.Entry_ID
_RDC_constraint.RDC_constraint_list_ID
1 . . . . . . . . . . . . . . . . -1.13 . . . . a 3 . N a 3 . HN parsed_2m0a 1
2 . . . . . . . . . . . . . . . . -0.14 . . . . a 4 . N a 4 . HN parsed_2m0a 1
3 . . . . . . . . . . . . . . . . -1.59 . . . . a 5 . N a 5 . HN parsed_2m0a 1
4 . . . . . . . . . . . . . . . . -1.64 . . . . a 6 . N a 6 . HN parsed_2m0a 1
5 . . . . . . . . . . . . . . . . -1.24 . . . . a 7 . N a 7 . HN parsed_2m0a 1
6 . . . . . . . . . . . . . . . . -1.73 . . . . a 8 . N a 8 . HN parsed_2m0a 1
7 . . . . . . . . . . . . . . . . -0.8 . . . . a 9 . N a 9 . HN parsed_2m0a 1
8 . . . . . . . . . . . . . . . . -2.09 . . . . a 11 . N a 11 . HN parsed_2m0a 1
9 . . . . . . . . . . . . . . . . 1.48 . . . . a 12 . N a 12 . HN parsed_2m0a 1
10 . . . . . . . . . . . . . . . . -4.97 . . . . a 13 . N a 13 . HN parsed_2m0a 1
11 . . . . . . . . . . . . . . . . -6.14 . . . . a 14 . N a 14 . HN parsed_2m0a 1
12 . . . . . . . . . . . . . . . . -12.34 . . . . a 18 . N a 18 . HN parsed_2m0a 1
13 . . . . . . . . . . . . . . . . 4.64 . . . . a 20 . N a 20 . HN parsed_2m0a 1
14 . . . . . . . . . . . . . . . . 0.97 . . . . a 22 . N a 22 . HN parsed_2m0a 1
15 . . . . . . . . . . . . . . . . -3.2 . . . . a 24 . N a 24 . HN parsed_2m0a 1
16 . . . . . . . . . . . . . . . . 3.91 . . . . a 26 . N a 26 . HN parsed_2m0a 1
17 . . . . . . . . . . . . . . . . -2.6 . . . . a 27 . N a 27 . HN parsed_2m0a 1
18 . . . . . . . . . . . . . . . . -11.16 . . . . a 31 . N a 31 . HN parsed_2m0a 1
19 . . . . . . . . . . . . . . . . 10.48 . . . . a 32 . N a 32 . HN parsed_2m0a 1
20 . . . . . . . . . . . . . . . . 1.74 . . . . a 39 . N a 39 . HN parsed_2m0a 1
21 . . . . . . . . . . . . . . . . 5.74 . . . . a 41 . N a 41 . HN parsed_2m0a 1
22 . . . . . . . . . . . . . . . . 4.54 . . . . a 43 . N a 43 . HN parsed_2m0a 1
23 . . . . . . . . . . . . . . . . -1.6 . . . . a 44 . N a 44 . HN parsed_2m0a 1
24 . . . . . . . . . . . . . . . . 7.35 . . . . a 45 . N a 45 . HN parsed_2m0a 1
25 . . . . . . . . . . . . . . . . 4.12 . . . . a 46 . N a 46 . HN parsed_2m0a 1
26 . . . . . . . . . . . . . . . . 0.43 . . . . a 47 . N a 47 . HN parsed_2m0a 1
27 . . . . . . . . . . . . . . . . 0.57 . . . . a 49 . N a 49 . HN parsed_2m0a 1
28 . . . . . . . . . . . . . . . . 5.32 . . . . a 50 . N a 50 . HN parsed_2m0a 1
29 . . . . . . . . . . . . . . . . 0.71 . . . . a 54 . N a 54 . HN parsed_2m0a 1
30 . . . . . . . . . . . . . . . . 7.33 . . . . a 56 . N a 56 . HN parsed_2m0a 1
31 . . . . . . . . . . . . . . . . -0.54 . . . . a 57 . N a 57 . HN parsed_2m0a 1
32 . . . . . . . . . . . . . . . . 5.64 . . . . a 59 . N a 59 . HN parsed_2m0a 1
33 . . . . . . . . . . . . . . . . 4.3 . . . . a 62 . N a 62 . HN parsed_2m0a 1
34 . . . . . . . . . . . . . . . . 1.12 . . . . a 64 . N a 64 . HN parsed_2m0a 1
35 . . . . . . . . . . . . . . . . 0.45 . . . . a 72 . N a 72 . HN parsed_2m0a 1
36 . . . . . . . . . . . . . . . . 0.87 . . . . a 75 . N a 75 . HN parsed_2m0a 1
37 . . . . . . . . . . . . . . . . 4.75 . . . . a 76 . N a 76 . HN parsed_2m0a 1
38 . . . . . . . . . . . . . . . . 5.32 . . . . a 78 . N a 78 . HN parsed_2m0a 1
39 . . . . . . . . . . . . . . . . 4.52 . . . . a 89 . N a 89 . HN parsed_2m0a 1
40 . . . . . . . . . . . . . . . . 0.31 . . . . a 90 . N a 90 . HN parsed_2m0a 1
41 . . . . . . . . . . . . . . . . 3.38 . . . . a 92 . N a 92 . HN parsed_2m0a 1
42 . . . . . . . . . . . . . . . . 4.44 . . . . a 96 . N a 96 . HN parsed_2m0a 1
43 . . . . . . . . . . . . . . . . 0.67 . . . . a 101 . N a 101 . HN parsed_2m0a 1
44 . . . . . . . . . . . . . . . . -4.42 . . . . a 110 . N a 110 . HN parsed_2m0a 1
45 . . . . . . . . . . . . . . . . 1.8 . . . . a 114 . N a 114 . HN parsed_2m0a 1
stop_
loop_
_RDC_constraint_parse_err.ID
_RDC_constraint_parse_err.Content
_RDC_constraint_parse_err.Begin_line
_RDC_constraint_parse_err.Begin_column
_RDC_constraint_parse_err.End_line
_RDC_constraint_parse_err.End_column
_RDC_constraint_parse_err.Entry_ID
_RDC_constraint_parse_err.RDC_constraint_list_ID
1 "# stretched" 1 1 1 11 parsed_2m0a 1
stop_
save_
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