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 |
|
|
592096 |
2mu3   |
17899 | cing | 2-parsed | STAR | distance | hydrogen bond | simple |
data_2mu3_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mu3
_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_2mu3 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mu3
_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 2mu3 "Master copy" parsed_2mu3
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mu3
_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 2mu3.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 2 distance NOE simple 947 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 3 distance NOE ambi 240 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 4 distance NOE simple 559 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 5 distance NOE ambi 70 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 6 distance NOE simple 1392 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 7 distance NOE ambi 638 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 8 distance NOE simple 38 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 9 distance NOE ambi 8 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 10 distance "hydrogen bond" simple 0 parsed_2mu3 1
1 2mu3.mr . . XPLOR/CNS 11 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2mu3 1
1 2mu3.mr . . "MR format" 12 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mu3 1
stop_
save_
save_CNS/XPLOR_distance_constraints_10
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2mu3
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 10
_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 (resid 129 and name N) (resid 129 and name HN) (resid 125 and name O)
assign (resid 131 and name N) (resid 131 and name HN) (resid 129 and name O)
;
71 1 72 87 parsed_2mu3 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 "assign (resid 21 and name N) (resid 21 and name HN) (resid 17 and name O)" 2 1 2 84 parsed_2mu3 1
2 "assign (resid 25 and name N) (resid 25 and name HN) (resid 21 and name O)" 6 1 6 84 parsed_2mu3 1
3 "assign (resid 26 and name N) (resid 26 and name HN) (resid 22 and name O)" 7 1 7 84 parsed_2mu3 1
4 "assign (resid 32 and name N) (resid 32 and name HN) (resid 28 and name O)" 10 1 10 84 parsed_2mu3 1
5 "assign (resid 33 and name N) (resid 33 and name HN) (resid 29 and name O)" 11 1 11 84 parsed_2mu3 1
6 "assign (resid 44 and name N) (resid 44 and name HN) (resid 40 and name O)" 16 1 16 84 parsed_2mu3 1
7 "assign (resid 68 and name N) (resid 68 and name HN) (resid 64 and name O)" 27 1 27 84 parsed_2mu3 1
8 "assign (resid 73 and name N) (resid 73 and name HN) (resid 69 and name O)" 32 1 32 84 parsed_2mu3 1
9 "assign (resid 74 and name N) (resid 74 and name HN) (resid 70 and name O)" 33 1 33 84 parsed_2mu3 1
10 "assign (resid 75 and name N) (resid 75 and name HN) (resid 71 and name O)" 34 1 34 84 parsed_2mu3 1
11 "assign (resid 77 and name N) (resid 77 and name HN) (resid 73 and name O)" 35 1 35 84 parsed_2mu3 1
12 "assign (resid 94 and name N) (resid 94 and name HN) (resid 90 and name O)" 47 1 47 84 parsed_2mu3 1
13 "assign (resid 95 and name N) (resid 95 and name HN) (resid 91 and name O)" 48 1 48 84 parsed_2mu3 1
14 "assign (resid 96 and name N) (resid 96 and name HN) (resid 92 and name O)" 49 1 49 84 parsed_2mu3 1
15 "assign (resid 105 and name N) (resid 105 and name HN) (resid 101 and name O)" 55 1 55 84 parsed_2mu3 1
16 "assign (resid 109 and name N) (resid 109 and name HN) (resid 105 and name O)" 56 1 56 84 parsed_2mu3 1
17 "assign (resid 112 and name N) (resid 112 and name HN) (resid 108 and name O)" 57 1 57 84 parsed_2mu3 1
18 "assign (resid 113 and name N) (resid 113 and name HN) (resid 109 and name O)" 58 1 58 84 parsed_2mu3 1
19 "assign (resid 118 and name N) (resid 118 and name HN) (resid 114 and name O)" 62 1 62 84 parsed_2mu3 1
20 "assign (resid 119 and name N) (resid 119 and name HN) (resid 115 and name O)" 63 1 63 84 parsed_2mu3 1
21 "assign (resid 120 and name N) (resid 120 and name HN) (resid 116 and name O)" 64 1 64 84 parsed_2mu3 1
22 "assign (resid 121 and name N) (resid 121 and name HN) (resid 117 and name O)" 65 1 65 84 parsed_2mu3 1
23 "assign (resid 122 and name N) (resid 122 and name HN) (resid 118 and name O)" 66 1 66 84 parsed_2mu3 1
24 "assign (resid 123 and name N) (resid 123 and name HN) (resid 119 and name O)" 67 1 67 84 parsed_2mu3 1
25 "assign (resid 124 and name N) (resid 124 and name HN) (resid 120 and name O)" 68 1 68 84 parsed_2mu3 1
26 "assign (resid 127 and name N) (resid 127 and name HN) (resid 123 and name O)" 70 1 70 84 parsed_2mu3 1
stop_
save_
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