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 |
|
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621852 |
5lwc   |
34044 | cing | 2-parsed | STAR | distance | hydrogen bond | simple |
data_5lwc_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5lwc
_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_5lwc 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5lwc
_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 5lwc "Master copy" parsed_5lwc
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5lwc
_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 5lwc.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5lwc 1
1 5lwc.mr . . XPLOR/CNS 2 distance NOE simple 619 parsed_5lwc 1
1 5lwc.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 86 parsed_5lwc 1
1 5lwc.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 0 parsed_5lwc 1
1 5lwc.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5lwc 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5lwc
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1 "assign ( don and resid 50 and name HN and segid A) ( acc and resid 46 and name O and segid A)" 43 1 43 103 parsed_5lwc 1
stop_
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 3: daa_hbonds_fix.tab" 1 1 1 39 parsed_5lwc 1
2 "assign ( don and resid 6 and name HN and segid A) ( acc and resid 2 and name O and segid A)" 3 1 3 98 parsed_5lwc 1
3 "assign ( don and resid 7 and name HN and segid A) ( acc and resid 3 and name O and segid A)" 4 1 4 98 parsed_5lwc 1
4 "assign ( don and resid 8 and name HN and segid A) ( acc and resid 4 and name O and segid A)" 5 1 5 98 parsed_5lwc 1
5 "assign ( don and resid 9 and name HN and segid A) ( acc and resid 5 and name O and segid A)" 6 1 6 98 parsed_5lwc 1
6 "assign ( don and resid 10 and name HN and segid A) ( acc and resid 6 and name O and segid A)" 7 1 7 98 parsed_5lwc 1
7 "assign ( don and resid 11 and name HN and segid A) ( acc and resid 7 and name O and segid A)" 8 1 8 98 parsed_5lwc 1
8 "assign ( don and resid 12 and name HN and segid A) ( acc and resid 8 and name O and segid A)" 9 1 9 98 parsed_5lwc 1
9 "assign ( don and resid 17 and name HN and segid A) ( acc and resid 13 and name O and segid A)" 13 1 13 100 parsed_5lwc 1
10 "assign ( don and resid 18 and name HN and segid A) ( acc and resid 14 and name O and segid A)" 14 1 14 100 parsed_5lwc 1
11 "assign ( don and resid 19 and name HN and segid A) ( acc and resid 15 and name O and segid A)" 15 1 15 100 parsed_5lwc 1
12 "assign ( don and resid 20 and name HN and segid A) ( acc and resid 16 and name O and segid A)" 16 1 16 100 parsed_5lwc 1
13 "assign ( don and resid 21 and name HN and segid A) ( acc and resid 17 and name O and segid A)" 17 1 17 100 parsed_5lwc 1
14 "assign ( don and resid 22 and name HN and segid A) ( acc and resid 18 and name O and segid A)" 18 1 18 100 parsed_5lwc 1
15 "assign ( don and resid 27 and name HN and segid A) ( acc and resid 23 and name O and segid A)" 23 1 23 100 parsed_5lwc 1
16 "assign ( don and resid 28 and name HN and segid A) ( acc and resid 24 and name O and segid A)" 24 1 24 100 parsed_5lwc 1
17 "assign ( don and resid 29 and name HN and segid A) ( acc and resid 25 and name O and segid A)" 25 1 25 100 parsed_5lwc 1
18 "assign ( don and resid 30 and name HN and segid A) ( acc and resid 26 and name O and segid A)" 26 1 26 100 parsed_5lwc 1
19 "assign ( don and resid 31 and name HN and segid A) ( acc and resid 27 and name O and segid A)" 27 1 27 100 parsed_5lwc 1
20 "assign ( don and resid 32 and name HN and segid A) ( acc and resid 28 and name O and segid A)" 28 1 28 100 parsed_5lwc 1
21 "assign ( don and resid 39 and name HN and segid A) ( acc and resid 35 and name O and segid A)" 32 1 32 100 parsed_5lwc 1
22 "assign ( don and resid 40 and name HN and segid A) ( acc and resid 36 and name O and segid A)" 33 1 33 100 parsed_5lwc 1
23 "assign ( don and resid 41 and name HN and segid A) ( acc and resid 37 and name O and segid A)" 34 1 34 100 parsed_5lwc 1
24 "assign ( don and resid 42 and name HN and segid A) ( acc and resid 38 and name O and segid A)" 35 1 35 100 parsed_5lwc 1
25 "assign ( don and resid 43 and name HN and segid A) ( acc and resid 39 and name O and segid A)" 36 1 36 100 parsed_5lwc 1
26 "assign ( don and resid 44 and name HN and segid A) ( acc and resid 40 and name O and segid A)" 37 1 37 100 parsed_5lwc 1
27 "assign ( don and resid 45 and name HN and segid A) ( acc and resid 41 and name O and segid A)" 38 1 38 100 parsed_5lwc 1
28 "assign ( don and resid 46 and name HN and segid A) ( acc and resid 42 and name O and segid A)" 39 1 39 100 parsed_5lwc 1
29 "assign ( don and resid 47 and name HN and segid A) ( acc and resid 43 and name O and segid A)" 40 1 40 100 parsed_5lwc 1
30 "assign ( don and resid 48 and name HN and segid A) ( acc and resid 44 and name O and segid A)" 41 1 41 100 parsed_5lwc 1
31 "assign ( don and resid 49 and name HN and segid A) ( acc and resid 45 and name O and segid A)" 42 1 42 100 parsed_5lwc 1
stop_
save_
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