NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
602782 |
5jn6   |
30070 | cing | 2-parsed | STAR | distance | hydrogen bond | simple |
data_5jn6_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5jn6
_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_5jn6 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5jn6
_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 5jn6 "Master copy" parsed_5jn6
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5jn6
_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 5jn6.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5jn6 1
1 5jn6.mr . . XPLOR/CNS 2 distance NOE simple 846 parsed_5jn6 1
1 5jn6.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 66 parsed_5jn6 1
1 5jn6.mr . . XPLOR/CNS 4 "coupling constant" "Not applicable" "Not applicable" 0 parsed_5jn6 1
1 5jn6.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 102 parsed_5jn6 1
1 5jn6.mr . . XPLOR/CNS 6 distance "hydrogen bond" simple 0 parsed_5jn6 1
1 5jn6.mr . . XPLOR/CNS 7 "chemical shift" "Not applicable" "Not applicable" 0 parsed_5jn6 1
1 5jn6.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5jn6 1
stop_
save_
save_CNS/XPLOR_distance_constraints_6
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5jn6
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 6
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Restraints file 5: HBDA.xplor" 1 1 1 31 parsed_5jn6 1
2
;
assign (resid 33 and name N )(resid 33 and name HN )
(resid 29 and name O )
;
2 1 3 35 parsed_5jn6 1
3
;
assign (resid 34 and name N )(resid 34 and name HN )
(resid 30 and name O )
;
4 1 5 35 parsed_5jn6 1
4
;
assign (resid 35 and name N )(resid 35 and name HN )
(resid 31 and name O )
;
6 1 7 35 parsed_5jn6 1
5
;
assign (resid 36 and name N )(resid 36 and name HN )
(resid 32 and name O )
;
8 1 9 35 parsed_5jn6 1
6
;
assign (resid 37 and name N )(resid 37 and name HN )
(resid 33 and name O )
;
10 1 11 35 parsed_5jn6 1
7
;
assign (resid 38 and name N )(resid 38 and name HN )
(resid 34 and name O )
;
12 1 13 35 parsed_5jn6 1
8
;
assign (resid 39 and name N )(resid 39 and name HN )
(resid 35 and name O )
;
14 1 15 35 parsed_5jn6 1
9
;
assign (resid 40 and name N )(resid 40 and name HN )
(resid 36 and name O )
;
16 1 17 35 parsed_5jn6 1
10
;
assign (resid 41 and name N )(resid 41 and name HN )
(resid 37 and name O )
;
18 1 19 35 parsed_5jn6 1
11
;
assign (resid 42 and name N )(resid 42 and name HN )
(resid 38 and name O )
;
20 1 21 35 parsed_5jn6 1
12
;
assign (resid 43 and name N )(resid 43 and name HN )
(resid 39 and name O )
;
22 1 23 35 parsed_5jn6 1
13
;
assign (resid 44 and name N )(resid 44 and name HN )
(resid 40 and name O )
;
24 1 25 35 parsed_5jn6 1
14
;
assign (resid 45 and name N )(resid 45 and name HN )
(resid 41 and name O )
;
26 1 27 35 parsed_5jn6 1
15
;
assign (resid 46 and name N )(resid 46 and name HN )
(resid 42 and name O )
;
28 1 29 35 parsed_5jn6 1
16
;
assign (resid 47 and name N )(resid 47 and name HN )
(resid 43 and name O )
;
30 1 31 35 parsed_5jn6 1
17
;
assign (resid 48 and name N )(resid 48 and name HN )
(resid 44 and name O )
;
32 1 33 35 parsed_5jn6 1
18
;
assign (resid 49 and name N )(resid 49 and name HN )
(resid 45 and name O )
;
34 1 35 35 parsed_5jn6 1
19
;
assign (resid 50 and name N )(resid 50 and name HN )
(resid 46 and name O )
;
36 1 37 35 parsed_5jn6 1
stop_
save_
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