NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type |
|
|
620898 |
5w3n   |
30304 | cing | 2-parsed | STAR | dipolar coupling |
data_5w3n_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5w3n
_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_5w3n 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5w3n
_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 5w3n "Master copy" parsed_5w3n
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5w3n
_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 5w3n.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5w3n 1
1 5w3n.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_5w3n 1
1 5w3n.mr . . XPLOR/CNS 3 distance NOE simple 0 parsed_5w3n 1
1 5w3n.mr . . XPLOR/CNS 4 distance NOE ambi 0 parsed_5w3n 1
1 5w3n.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_5w3n 1
1 5w3n.mr . . XPLOR/CNS 6 distance NOE simple 0 parsed_5w3n 1
1 5w3n.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_5w3n 1
1 5w3n.mr . . XPLOR/CNS 8 distance NOE ambi 0 parsed_5w3n 1
1 5w3n.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5w3n 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_2
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_5w3n
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 2
_RDC_constraint_list.Details "Generated by Wattos"
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 "# Restraints file 1: fus_CO_RDC.tbl" 1 1 1 35 parsed_5w3n 1
2
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 44 and name C)
(segid A5 and resid 44 and name O) 18.0 1.5 2.0
;
2 1 7 57 parsed_5w3n 1
3
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 45 and name C)
(segid A5 and resid 45 and name O) 18.0 1.5 2.0
;
8 1 13 57 parsed_5w3n 1
4
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 46 and name C)
(segid A5 and resid 46 and name O) 18.0 1.5 2.0
;
14 1 19 57 parsed_5w3n 1
5
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 52 and name C)
(segid A5 and resid 52 and name O) 18.0 1.5 2.0
;
20 1 25 57 parsed_5w3n 1
6
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 53 and name C)
(segid A5 and resid 53 and name O) 18.0 1.5 2.0
;
26 1 31 57 parsed_5w3n 1
7
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 54 and name C)
(segid A5 and resid 54 and name O) 18.0 1.5 2.0
;
32 1 37 57 parsed_5w3n 1
8
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 63 and name C)
(segid A5 and resid 63 and name O) 18.0 1.5 2.0
;
38 1 43 57 parsed_5w3n 1
9
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 64 and name C)
(segid A5 and resid 64 and name O) 18.0 1.5 2.0
;
44 1 49 57 parsed_5w3n 1
10
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 67 and name C)
(segid A5 and resid 67 and name O) 18.0 1.5 2.0
;
50 1 55 57 parsed_5w3n 1
11
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 68 and name C)
(segid A5 and resid 68 and name O) 18.0 1.5 2.0
;
56 1 61 57 parsed_5w3n 1
12
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 69 and name C)
(segid A5 and resid 69 and name O) 18.0 1.5 2.0
;
62 1 67 57 parsed_5w3n 1
13
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 70 and name C)
(segid A5 and resid 70 and name O) 18.0 1.5 2.0
;
68 1 73 57 parsed_5w3n 1
14
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 83 and name C)
(segid A5 and resid 83 and name O) 18.0 1.5 2.0
;
74 1 79 57 parsed_5w3n 1
15
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 84 and name C)
(segid A5 and resid 84 and name O) 18.0 1.5 2.0
;
80 1 85 57 parsed_5w3n 1
16
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 85 and name C)
(segid A5 and resid 85 and name O) 18.0 1.5 2.0
;
86 1 91 57 parsed_5w3n 1
17
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 86 and name C)
(segid A5 and resid 86 and name O) 18.0 1.5 2.0
;
92 1 97 57 parsed_5w3n 1
18
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 87 and name C)
(segid A5 and resid 87 and name O) 18.0 1.5 2.0
;
98 1 103 57 parsed_5w3n 1
19
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 88 and name C)
(segid A5 and resid 88 and name O) 18.0 1.5 2.0
;
104 1 109 57 parsed_5w3n 1
20
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 89 and name C)
(segid A5 and resid 89 and name O) 18.0 1.5 2.0
;
110 1 115 57 parsed_5w3n 1
21
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 90 and name C)
(segid A5 and resid 90 and name O) 18.0 1.5 2.0
;
116 1 121 57 parsed_5w3n 1
22
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 93 and name C)
(segid A5 and resid 93 and name O) 18.0 1.5 2.0
;
122 1 127 57 parsed_5w3n 1
23
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 94 and name C)
(segid A5 and resid 94 and name O) 18.0 1.5 2.0
;
128 1 133 57 parsed_5w3n 1
24
;
assign (resid 500 OO)
(resid 500 X)
(resid 500 Y)
(resid 500 Z)
(segid A5 and resid 95 and name C)
(segid A5 and resid 95 and name O) 18.0 1.5 2.0
;
134 1 139 57 parsed_5w3n 1
stop_
save_
Contact the webmaster for help, if required. Thursday, May 2, 2024 12:46:42 AM GMT (wattos1)