NMR Restraints Grid
| |
NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
49810 |
2jw5   |
cing | 2-parsed | STAR | dipolar coupling | 37 |
data_2jw5_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2jw5
_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_2jw5 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2jw5
_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 2jw5 "Master copy" parsed_2jw5
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2jw5
_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 2jw5.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2jw5 1
1 2jw5.mr . . XPLOR/CNS 2 distance NOE simple 1916 parsed_2jw5 1
1 2jw5.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 115 parsed_2jw5 1
1 2jw5.mr . . XPLOR/CNS 4 unknown "Not applicable" "Not applicable" 0 parsed_2jw5 1
1 2jw5.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 37 parsed_2jw5 1
1 2jw5.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2jw5 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2jw5
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 5
_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 . . . . . . . . . . . . . . . . 32.883 . . . . . 15 . HN . 15 . N parsed_2jw5 1
2 . . . . . . . . . . . . . . . . 14.392 . . . . . 16 . HN . 16 . N parsed_2jw5 1
3 . . . . . . . . . . . . . . . . 9.273 . . . . . 19 . HN . 19 . N parsed_2jw5 1
4 . . . . . . . . . . . . . . . . -12.647 . . . . . 20 . HN . 20 . N parsed_2jw5 1
5 . . . . . . . . . . . . . . . . 0.500 . . . . . 24 . HN . 24 . N parsed_2jw5 1
6 . . . . . . . . . . . . . . . . -29.543 . . . . . 30 . HN . 30 . N parsed_2jw5 1
7 . . . . . . . . . . . . . . . . -1.190 . . . . . 31 . HN . 31 . N parsed_2jw5 1
8 . . . . . . . . . . . . . . . . -14.687 . . . . . 32 . HN . 32 . N parsed_2jw5 1
9 . . . . . . . . . . . . . . . . -39.551 . . . . . 33 . HN . 33 . N parsed_2jw5 1
10 . . . . . . . . . . . . . . . . -1.770 . . . . . 35 . HN . 35 . N parsed_2jw5 1
11 . . . . . . . . . . . . . . . . -33.318 . . . . . 37 . HN . 37 . N parsed_2jw5 1
12 . . . . . . . . . . . . . . . . 6.864 . . . . . 51 . HN . 51 . N parsed_2jw5 1
13 . . . . . . . . . . . . . . . . 30.733 . . . . . 52 . HN . 52 . N parsed_2jw5 1
14 . . . . . . . . . . . . . . . . 14.487 . . . . . 53 . HN . 53 . N parsed_2jw5 1
15 . . . . . . . . . . . . . . . . -24.225 . . . . . 54 . HN . 54 . N parsed_2jw5 1
16 . . . . . . . . . . . . . . . . 9.068 . . . . . 55 . HN . 55 . N parsed_2jw5 1
17 . . . . . . . . . . . . . . . . -24.299 . . . . . 57 . HN . 57 . N parsed_2jw5 1
18 . . . . . . . . . . . . . . . . 27.394 . . . . . 60 . HN . 60 . N parsed_2jw5 1
19 . . . . . . . . . . . . . . . . -13.927 . . . . . 62 . HN . 62 . N parsed_2jw5 1
20 . . . . . . . . . . . . . . . . 9.048 . . . . . 64 . HN . 64 . N parsed_2jw5 1
21 . . . . . . . . . . . . . . . . 10.543 . . . . . 66 . HN . 66 . N parsed_2jw5 1
22 . . . . . . . . . . . . . . . . -7.048 . . . . . 69 . HN . 69 . N parsed_2jw5 1
23 . . . . . . . . . . . . . . . . 9.178 . . . . . 70 . HN . 70 . N parsed_2jw5 1
24 . . . . . . . . . . . . . . . . 23.380 . . . . . 73 . HN . 73 . N parsed_2jw5 1
25 . . . . . . . . . . . . . . . . 11.822 . . . . . 74 . HN . 74 . N parsed_2jw5 1
26 . . . . . . . . . . . . . . . . 15.971 . . . . . 78 . HN . 78 . N parsed_2jw5 1
27 . . . . . . . . . . . . . . . . 37.352 . . . . . 79 . HN . 79 . N parsed_2jw5 1
28 . . . . . . . . . . . . . . . . 5.234 . . . . . 81 . HN . 81 . N parsed_2jw5 1
29 . . . . . . . . . . . . . . . . -10.478 . . . . . 83 . HN . 83 . N parsed_2jw5 1
30 . . . . . . . . . . . . . . . . -16.246 . . . . . 86 . HN . 86 . N parsed_2jw5 1
31 . . . . . . . . . . . . . . . . -1.805 . . . . . 87 . HN . 87 . N parsed_2jw5 1
32 . . . . . . . . . . . . . . . . 23.540 . . . . . 88 . HN . 88 . N parsed_2jw5 1
33 . . . . . . . . . . . . . . . . 10.258 . . . . . 89 . HN . 89 . N parsed_2jw5 1
34 . . . . . . . . . . . . . . . . -3.629 . . . . . 90 . HN . 90 . N parsed_2jw5 1
35 . . . . . . . . . . . . . . . . 8.383 . . . . . 91 . HN . 91 . N parsed_2jw5 1
36 . . . . . . . . . . . . . . . . -4.274 . . . . . 92 . HN . 92 . N parsed_2jw5 1
37 . . . . . . . . . . . . . . . . -30.673 . . . . . 93 . HN . 93 . N parsed_2jw5 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 "#rdcs2.tbl" 2 1 2 10 parsed_2jw5 1
stop_
save_
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