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 |
|
|
516928 |
2k3b   |
16843 | cing | 2-parsed | STAR | dipolar coupling |
data_2k3b_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k3b
_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_2k3b 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k3b
_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 2k3b "Master copy" parsed_2k3b
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k3b
_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 2k3b.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 25 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 1 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 2 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 5 unknown "Not applicable" "Not applicable" 0 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 70 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 16 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 8 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 9 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k3b 1
1 2k3b.mr . . XPLOR/CNS 10 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k3b 1
1 2k3b.mr . . "MR format" 11 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k3b 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_8
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k3b
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 8
_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
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 6 and name C )
( resid 6 and name O )
( resid 7 and name N ) -48.529412 10.000000 10.000000
;
1 1 7 67 parsed_2k3b 1
2
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 7 and name C )
( resid 7 and name O )
( resid 8 and name N ) -17.254902 10.000000 10.000000
;
9 1 15 67 parsed_2k3b 1
3
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 8 and name C )
( resid 8 and name O )
( resid 9 and name N ) 19.052288 10.000000 10.000000
;
17 1 23 66 parsed_2k3b 1
4
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 9 and name C )
( resid 9 and name O )
( resid 10 and name N ) -23.006536 10.000000 10.000000
;
25 1 31 67 parsed_2k3b 1
5
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 13 and name C )
( resid 13 and name O )
( resid 14 and name N ) -69.738562 10.000000 10.000000
;
33 1 39 67 parsed_2k3b 1
6
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 15 and name C )
( resid 15 and name O )
( resid 16 and name N ) 30.555556 10.000000 10.000000
;
41 1 47 66 parsed_2k3b 1
7
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 31 and name C )
( resid 31 and name O )
( resid 32 and name N ) 60.392157 10.000000 10.000000
;
49 1 55 66 parsed_2k3b 1
8
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 32 and name C )
( resid 32 and name O )
( resid 33 and name N ) -36.307190 20.130719 20.130719
;
57 1 63 67 parsed_2k3b 1
9
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 34 and name C )
( resid 34 and name O )
( resid 35 and name N ) 4.673203 10.000000 10.000000
;
65 1 71 65 parsed_2k3b 1
10
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 36 and name C )
( resid 36 and name O )
( resid 37 and name N ) -48.888889 10.000000 10.000000
;
73 1 79 67 parsed_2k3b 1
11
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 37 and name C )
( resid 37 and name O )
( resid 38 and name N ) -15.816993 10.000000 10.000000
;
81 1 87 67 parsed_2k3b 1
12
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 52 and name C )
( resid 52 and name O )
( resid 53 and name N ) -90.228758 10.000000 10.000000
;
89 1 95 67 parsed_2k3b 1
13
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 53 and name C )
( resid 53 and name O )
( resid 54 and name N ) 34.869281 10.000000 10.000000
;
97 1 103 66 parsed_2k3b 1
14
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 54 and name C )
( resid 54 and name O )
( resid 55 and name N ) 6.470588 10.000000 10.000000
;
105 1 111 65 parsed_2k3b 1
stop_
save_
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