NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
38093 |
1qtg   |
4540 | cing | 2-parsed | STAR | entry | full | 99 |
data_1qtg_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1qtg
_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_1qtg 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1qtg
_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 1qtg "Master copy" parsed_1qtg
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1qtg
_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 1qtg.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1qtg 1
1 1qtg.mr . . XPLOR/CNS 2 distance NOE ambi 99 parsed_1qtg 1
1 1qtg.mr . . STAR 3 sequence "Not applicable" "Not applicable" 0 parsed_1qtg 1
1 1qtg.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1qtg 1
1 1qtg.mr . . STAR 5 "chemical shift" "Not applicable" "Not applicable" 0 parsed_1qtg 1
1 1qtg.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1qtg 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1qtg
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
*HEADER GENE REGULATION 27-JUN-99 1QTG
*TITLE AVERAGED NMR MODEL OF SWITCH ARC, A DOUBLE MUTANT OF ARC
*TITLE 2 REPRESSOR
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: ARC REPRESSOR;
*COMPND 3 CHAIN: A, B;
*COMPND 4 ENGINEERED: YES;
*COMPND 5 MUTATION: N11L, L12N;
*COMPND 6 BIOLOGICAL_UNIT: DIMER
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: BACTERIOPHAGE P22;
*SOURCE 3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 4 EXPRESSION_SYSTEM_COMMON: BACTERIA;
*SOURCE 5 EXPRESSION_SYSTEM_VECTOR: PLASMID;
*SOURCE 6 EXPRESSION_SYSTEM_PLASMID: PET800-SWITCH_ARC;
*SOURCE 7 OTHER_DETAILS: MUTATED SYNTHETIC ARC GENE
*KEYWDS BETA-SHEET, RIGHT-HANDED HELIX, STRUCTURAL CHANGE
*EXPDTA NMR
*AUTHOR M.H.J.CORDES, N.P.WALSH, C.J.MCKNIGHT, R.T.SAUER
*REVDAT 1 12-JUL-99 1QTG 0
{*constraints from 2d noesy*}
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1qtg
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_1qtg 1
2 1 . . . parsed_1qtg 1
3 1 . . . parsed_1qtg 1
4 1 . . . parsed_1qtg 1
5 1 . . . parsed_1qtg 1
6 1 . . . parsed_1qtg 1
7 1 . . . parsed_1qtg 1
8 1 . . . parsed_1qtg 1
9 1 . . . parsed_1qtg 1
10 1 . . . parsed_1qtg 1
11 1 . . . parsed_1qtg 1
12 1 . . . parsed_1qtg 1
13 1 . . . parsed_1qtg 1
14 1 . . . parsed_1qtg 1
15 1 . . . parsed_1qtg 1
16 1 . . . parsed_1qtg 1
17 1 . . . parsed_1qtg 1
18 1 . . . parsed_1qtg 1
19 1 . . . parsed_1qtg 1
20 1 . . . parsed_1qtg 1
21 1 . . . parsed_1qtg 1
22 1 . . . parsed_1qtg 1
23 1 . . . parsed_1qtg 1
24 1 . . . parsed_1qtg 1
25 1 . . . parsed_1qtg 1
26 1 . . . parsed_1qtg 1
27 1 . . . parsed_1qtg 1
28 1 . . . parsed_1qtg 1
29 1 . . . parsed_1qtg 1
30 1 . . . parsed_1qtg 1
31 1 . . . parsed_1qtg 1
32 1 . . . parsed_1qtg 1
33 1 . . . parsed_1qtg 1
34 1 . . . parsed_1qtg 1
35 1 . . . parsed_1qtg 1
36 1 . . . parsed_1qtg 1
37 1 . . . parsed_1qtg 1
38 1 . . . parsed_1qtg 1
39 1 . . . parsed_1qtg 1
40 1 . . . parsed_1qtg 1
41 1 . . . parsed_1qtg 1
42 1 . . . parsed_1qtg 1
43 1 . . . parsed_1qtg 1
44 1 . . . parsed_1qtg 1
45 1 . . . parsed_1qtg 1
46 1 . . . parsed_1qtg 1
47 1 . . . parsed_1qtg 1
48 1 . . . parsed_1qtg 1
49 1 . . . parsed_1qtg 1
50 1 . . . parsed_1qtg 1
51 1 . . . parsed_1qtg 1
52 1 . . . parsed_1qtg 1
53 1 . . . parsed_1qtg 1
54 1 . . . parsed_1qtg 1
55 1 . . . parsed_1qtg 1
56 1 . . . parsed_1qtg 1
57 1 . . . parsed_1qtg 1
58 1 . . . parsed_1qtg 1
59 1 . . . parsed_1qtg 1
60 1 . . . parsed_1qtg 1
61 1 . . . parsed_1qtg 1
62 1 . . . parsed_1qtg 1
63 1 . . . parsed_1qtg 1
64 1 . . . parsed_1qtg 1
65 1 . . . parsed_1qtg 1
66 1 . . . parsed_1qtg 1
67 1 . . . parsed_1qtg 1
68 1 . . . parsed_1qtg 1
69 1 . . . parsed_1qtg 1
70 1 . . . parsed_1qtg 1
71 1 . . . parsed_1qtg 1
72 1 . . . parsed_1qtg 1
73 1 . . . parsed_1qtg 1
74 1 . . . parsed_1qtg 1
75 1 . . . parsed_1qtg 1
76 1 . . . parsed_1qtg 1
77 1 . . . parsed_1qtg 1
78 1 . . . parsed_1qtg 1
79 1 . . . parsed_1qtg 1
80 1 . . . parsed_1qtg 1
81 1 . . . parsed_1qtg 1
82 1 . . . parsed_1qtg 1
83 1 . . . parsed_1qtg 1
84 1 . . . parsed_1qtg 1
85 1 . . . parsed_1qtg 1
86 1 . . . parsed_1qtg 1
87 1 . . . parsed_1qtg 1
88 1 . . . parsed_1qtg 1
89 1 . . . parsed_1qtg 1
90 1 . . . parsed_1qtg 1
91 1 . . . parsed_1qtg 1
92 1 . . . parsed_1qtg 1
93 1 . . . parsed_1qtg 1
94 1 . . . parsed_1qtg 1
95 1 . . . parsed_1qtg 1
96 1 . . . parsed_1qtg 1
97 1 . . . parsed_1qtg 1
98 1 . . . parsed_1qtg 1
99 1 . . . parsed_1qtg 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . . 7 . ha parsed_1qtg 1
1 1 2 . . . . . . . . . 8 . hd# parsed_1qtg 1
2 1 1 . . . . . . . . . 8 . ha parsed_1qtg 1
2 1 2 . . . . . . . . . 9 . hn parsed_1qtg 1
3 1 1 . . . . . . . . . 10 . ha parsed_1qtg 1
3 1 2 . . . . . . . . . 10 . hd# parsed_1qtg 1
4 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
4 1 2 . . . . . . . . . 10 . hd# parsed_1qtg 1
5 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
5 1 2 . . . . . . . . . 33 . hg1# parsed_1qtg 1
6 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
6 1 2 . . . . . . . . . 19 . hd## parsed_1qtg 1
7 1 1 . . . . . . . . . 34 . ha parsed_1qtg 1
7 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
7 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
8 1 1 . . . . . . . . . 37 . hg2# parsed_1qtg 1
8 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
8 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
9 1 1 . . . . . . . . . 33 . hg1# parsed_1qtg 1
9 1 1 . . . . . . . . . 37 . hd1# parsed_1qtg 1
9 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
9 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
10 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
10 1 2 . . . . . . . . . 11 . ha parsed_1qtg 1
11 1 1 . . . . . . . . . 11 . hn parsed_1qtg 1
11 1 2 . . . . . . . . . 12 . hn parsed_1qtg 1
12 1 1 . . . . . . . . . 14 . hn parsed_1qtg 1
12 1 2 . . . . . . . . . 14 . hd1 parsed_1qtg 1
13 1 1 . . . . . . . . . 14 . ha parsed_1qtg 1
13 1 2 . . . . . . . . . 14 . hd1 parsed_1qtg 1
14 1 1 . . . . . . . . . 11 . hd1# parsed_1qtg 1
14 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
14 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
15 1 1 . . . . . . . . . 11 . hd2# parsed_1qtg 1
15 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
15 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
16 1 1 . . . . . . . . . 8 . hg# parsed_1qtg 1
16 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
16 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
17 1 1 . . . . . . . . . 8 . hb1 parsed_1qtg 1
17 1 2 . . . . . . . . . 10 . hd# parsed_1qtg 1
18 1 1 . . . . . . . . . 37 . hb parsed_1qtg 1
18 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
18 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
19 1 1 . . . . . . . . . 11 . hg parsed_1qtg 1
19 1 2 . . . . . . . . . 11 . hn parsed_1qtg 1
20 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
20 1 2 . . . . . . . . . 8 . hd# parsed_1qtg 1
21 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
21 1 2 . . . . . . . . . 8 . hg# parsed_1qtg 1
22 1 1 . . . . . . . . . 14 . hz2 parsed_1qtg 1
22 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
22 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
23 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
23 1 2 . . . . . . . . . 37 . hd1# parsed_1qtg 1
24 1 1 . . . . . . . . . 11 . hg parsed_1qtg 1
24 1 2 . . . . . . . . . 10 . hd# parsed_1qtg 1
25 1 1 . . . . . . . . . 13 . ha parsed_1qtg 1
25 1 2 . . . . . . . . . 14 . hn parsed_1qtg 1
26 1 1 . . . . . . . . . 8 . hb2 parsed_1qtg 1
26 1 2 . . . . . . . . . 10 . hd# parsed_1qtg 1
27 1 1 . . . . . . . . . 8 . hg# parsed_1qtg 1
27 1 2 . . . . . . . . . 10 . hd# parsed_1qtg 1
28 1 1 . . . . . . . . . 8 . hb1 parsed_1qtg 1
28 1 2 . . . . . . . . . 9 . hn parsed_1qtg 1
29 1 1 . . . . . . . . . 8 . hb2 parsed_1qtg 1
29 1 2 . . . . . . . . . 9 . hn parsed_1qtg 1
30 1 1 . . . . . . . . . 8 . hb2 parsed_1qtg 1
30 1 2 . . . . . . . . . 10 . hn parsed_1qtg 1
31 1 1 . . . . . . . . . 8 . hd# parsed_1qtg 1
31 1 2 . . . . . . . . . 19 . hd## parsed_1qtg 1
32 1 1 . . . . . . . . . 9 . hn parsed_1qtg 1
32 1 2 . . . . . . . . . 10 . hn parsed_1qtg 1
33 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
33 1 2 . . . . . . . . . 8 . hb2 parsed_1qtg 1
34 1 1 . . . . . . . . . 10 . hn parsed_1qtg 1
34 1 2 . . . . . . . . . 10 . hd# parsed_1qtg 1
35 1 1 . . . . . . . . . 10 . ha parsed_1qtg 1
35 1 2 . . . . . . . . . 34 . hd2# parsed_1qtg 1
36 1 1 . . . . . . . . . 11 . hg parsed_1qtg 1
36 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
36 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
37 1 1 . . . . . . . . . 8 . hb2 parsed_1qtg 1
37 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
37 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
38 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
38 1 2 . . . . . . . . . 14 . he3 parsed_1qtg 1
39 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
39 1 2 . . . . . . . . . 14 . hz2 parsed_1qtg 1
40 1 1 . . . . . . . . . 12 . hn parsed_1qtg 1
40 1 2 . . . . . . . . . 13 . hn parsed_1qtg 1
41 1 1 . . . . . . . . . 13 . hb# parsed_1qtg 1
41 1 2 . . . . . . . . . 14 . hd1 parsed_1qtg 1
42 1 1 . . . . . . . . . 13 . hn parsed_1qtg 1
42 1 2 . . . . . . . . . 14 . hd1 parsed_1qtg 1
43 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
43 1 2 . . . . . . . . . 7 . ha parsed_1qtg 1
44 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
44 1 2 . . . . . . . . . 7 . hg# parsed_1qtg 1
45 1 1 . . . . . . . . . 8 . ha parsed_1qtg 1
45 1 2 . . . . . . . . . 10 . he# parsed_1qtg 1
45 1 2 . . . . . . . . . 10 . hz parsed_1qtg 1
46 1 1 . . . . . . . . . 8 . ha parsed_1qtg 1
46 1 2 . . . . . . . . . 10 . hd# parsed_1qtg 1
47 1 1 . . . . . . . . . 9 . ha parsed_1qtg 1
47 1 2 . . . . . . . . . 12 . hb# parsed_1qtg 1
48 1 1 . . . . . . . . . 11 . hg parsed_1qtg 1
48 1 2 . . . . . . . . . 10 . hn parsed_1qtg 1
49 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
49 1 2 . . . . . . . . . 14 . hz3 parsed_1qtg 1
50 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
50 1 2 . . . . . . . . . 14 . he1 parsed_1qtg 1
51 1 1 . . . . . . . . . 14 . he3 parsed_1qtg 1
51 1 2 . . . . . . . . . 19 . hd## parsed_1qtg 1
52 1 1 . . . . . . . . . 14 . hz2 parsed_1qtg 1
52 1 2 . . . . . . . . . 37 . hg2# parsed_1qtg 1
53 1 1 . . . . . . . . . 14 . hh2 parsed_1qtg 1
53 1 2 . . . . . . . . . 37 . hg2# parsed_1qtg 1
54 1 1 . . . . . . . . . 14 . hz3 parsed_1qtg 1
54 1 2 . . . . . . . . . 22 . hg2# parsed_1qtg 1
54 1 2 . . . . . . . . . 37 . hg1# parsed_1qtg 1
55 1 1 . . . . . . . . . 14 . hh2 parsed_1qtg 1
55 1 2 . . . . . . . . . 37 . hd1# parsed_1qtg 1
56 1 1 . . . . . . . . . 14 . hh2 parsed_1qtg 1
56 1 2 . . . . . . . . . 37 . hg1# parsed_1qtg 1
56 1 2 . . . . . . . . . 41 . hb parsed_1qtg 1
57 1 1 . . . . . . . . . 14 . hz3 parsed_1qtg 1
57 1 2 . . . . . . . . . 37 . hd1# parsed_1qtg 1
58 1 1 . . . . . . . . . 14 . hz2 parsed_1qtg 1
58 1 2 . . . . . . . . . 37 . hb parsed_1qtg 1
59 1 1 . . . . . . . . . 14 . hz2 parsed_1qtg 1
59 1 2 . . . . . . . . . 37 . hd1# parsed_1qtg 1
60 1 1 . . . . . . . . . 14 . hn parsed_1qtg 1
60 1 2 . . . . . . . . . 19 . hd## parsed_1qtg 1
61 1 1 . . . . . . . . . 14 . hz3 parsed_1qtg 1
61 1 2 . . . . . . . . . 41 . hg2# parsed_1qtg 1
62 1 1 . . . . . . . . . 14 . hh2 parsed_1qtg 1
62 1 2 . . . . . . . . . 41 . hg2# parsed_1qtg 1
63 1 1 . . . . . . . . . 14 . hz3 parsed_1qtg 1
63 1 2 . . . . . . . . . 41 . hg1# parsed_1qtg 1
64 1 1 . . . . . . . . . 14 . hh2 parsed_1qtg 1
64 1 2 . . . . . . . . . 41 . hg1# parsed_1qtg 1
65 1 1 . . . . . . . . . 14 . he3 parsed_1qtg 1
65 1 2 . . . . . . . . . 22 . hg2# parsed_1qtg 1
65 1 2 . . . . . . . . . 37 . hg1# parsed_1qtg 1
66 1 1 . . . . . . . . . 14 . hd1 parsed_1qtg 1
66 1 2 . . . . . . . . . 15 . hd# parsed_1qtg 1
67 1 1 . . . . . . . . . 14 . he3 parsed_1qtg 1
67 1 2 . . . . . . . . . 38 . he# parsed_1qtg 1
68 1 1 . . . . . . . . . 14 . he3 parsed_1qtg 1
68 1 2 . . . . . . . . . 38 . hd# parsed_1qtg 1
69 1 1 . . . . . . . . . 14 . hz3 parsed_1qtg 1
69 1 2 . . . . . . . . . 38 . hd# parsed_1qtg 1
70 1 1 . . . . . . . . . 14 . hz2 parsed_1qtg 1
70 1 2 . . . . . . . . . 38 . hd# parsed_1qtg 1
71 1 1 . . . . . . . . . 14 . hz2 parsed_1qtg 1
71 1 2 . . . . . . . . . 38 . hn parsed_1qtg 1
72 1 1 . . . . . . . . . 14 . he1 parsed_1qtg 1
72 1 2 . . . . . . . . . 38 . hb# parsed_1qtg 1
73 1 1 . . . . . . . . . 14 . he3 parsed_1qtg 1
73 1 2 . . . . . . . . . 19 . hg parsed_1qtg 1
74 1 1 . . . . . . . . . 14 . he3 parsed_1qtg 1
74 1 2 . . . . . . . . . 19 . ha parsed_1qtg 1
75 1 1 . . . . . . . . . 14 . hz2 parsed_1qtg 1
75 1 2 . . . . . . . . . 34 . ha parsed_1qtg 1
76 1 1 . . . . . . . . . 14 . he1 parsed_1qtg 1
76 1 2 . . . . . . . . . 34 . hd2# parsed_1qtg 1
77 1 1 . . . . . . . . . 14 . hz3 parsed_1qtg 1
77 1 2 . . . . . . . . . 37 . hg1# parsed_1qtg 1
77 1 2 . . . . . . . . . 41 . hb parsed_1qtg 1
78 1 1 . . . . . . . . . 14 . hz2 parsed_1qtg 1
78 1 2 . . . . . . . . . 37 . hg1# parsed_1qtg 1
78 1 2 . . . . . . . . . 41 . hb parsed_1qtg 1
79 1 1 . . . . . . . . . 14 . hb# parsed_1qtg 1
79 1 2 . . . . . . . . . 38 . he# parsed_1qtg 1
80 1 1 . . . . . . . . . 14 . hd1 parsed_1qtg 1
80 1 2 . . . . . . . . . 38 . hd# parsed_1qtg 1
81 1 1 . . . . . . . . . 14 . he3 parsed_1qtg 1
81 1 2 . . . . . . . . . 18 . hb parsed_1qtg 1
82 1 1 . . . . . . . . . 7 . hg# parsed_1qtg 1
82 1 2 . . . . . . . . . 12 . hn parsed_1qtg 1
83 1 1 . . . . . . . . . 7 . hg# parsed_1qtg 1
83 1 1 . . . . . . . . . 15 . hb# parsed_1qtg 1
83 1 2 . . . . . . . . . 14 . hn parsed_1qtg 1
84 1 1 . . . . . . . . . 8 . hg# parsed_1qtg 1
84 1 2 . . . . . . . . . 10 . hn parsed_1qtg 1
85 1 1 . . . . . . . . . 8 . hb2 parsed_1qtg 1
85 1 2 . . . . . . . . . 11 . hn parsed_1qtg 1
86 1 1 . . . . . . . . . 8 . hg# parsed_1qtg 1
86 1 2 . . . . . . . . . 11 . hn parsed_1qtg 1
87 1 1 . . . . . . . . . 8 . hg# parsed_1qtg 1
87 1 2 . . . . . . . . . 9 . hn parsed_1qtg 1
88 1 1 . . . . . . . . . 8 . hd# parsed_1qtg 1
88 1 2 . . . . . . . . . 34 . hn parsed_1qtg 1
89 1 1 . . . . . . . . . 9 . ha parsed_1qtg 1
89 1 2 . . . . . . . . . 12 . hn parsed_1qtg 1
90 1 1 . . . . . . . . . 9 . ha parsed_1qtg 1
90 1 2 . . . . . . . . . 12 . hd2# parsed_1qtg 1
91 1 1 . . . . . . . . . 12 . ha parsed_1qtg 1
91 1 2 . . . . . . . . . 14 . hn parsed_1qtg 1
92 1 1 . . . . . . . . . 9 . ha parsed_1qtg 1
92 1 2 . . . . . . . . . 13 . hn parsed_1qtg 1
93 1 1 . . . . . . . . . 10 . ha parsed_1qtg 1
93 1 1 . . . . . . . . . 19 . ha parsed_1qtg 1
93 1 2 . . . . . . . . . 14 . hn parsed_1qtg 1
94 1 1 . . . . . . . . . 9 . ha parsed_1qtg 1
94 1 2 . . . . . . . . . 11 . hn parsed_1qtg 1
95 1 1 . . . . . . . . . 11 . hg parsed_1qtg 1
95 1 2 . . . . . . . . . 14 . hn parsed_1qtg 1
96 1 1 . . . . . . . . . 14 . hn parsed_1qtg 1
96 1 2 . . . . . . . . . 18 . hb parsed_1qtg 1
97 1 1 . . . . . . . . . 11 . hg parsed_1qtg 1
97 1 2 . . . . . . . . . 9 . hn parsed_1qtg 1
98 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
98 1 2 . . . . . . . . . 33 . hn parsed_1qtg 1
99 1 1 . . . . . . . . . 11 . hd## parsed_1qtg 1
99 1 2 . . . . . . . . . 37 . hn parsed_1qtg 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
2 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
3 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
4 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
5 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
6 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
7 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
8 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
9 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
10 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
11 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
12 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
13 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
14 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
15 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
16 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
17 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
18 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
19 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
20 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
21 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
22 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
23 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
24 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
25 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
26 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
27 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
28 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
29 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
30 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
31 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
32 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
33 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
34 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
35 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
36 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
37 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
38 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
39 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
40 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
41 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
42 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
43 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
44 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
45 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
46 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
47 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
48 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
49 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
50 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
51 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
52 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
53 1 . . . . . 2.8 1.8 2.8 parsed_1qtg 1
54 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
55 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
56 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
57 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
58 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
59 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
60 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
61 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
62 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
63 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
64 1 . . . . . 3.3 1.8 3.3 parsed_1qtg 1
65 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
66 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
67 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
68 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
69 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
70 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
71 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
72 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
73 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
74 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
75 1 . . . . . 4.3 1.8 4.3 parsed_1qtg 1
76 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
77 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
78 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
79 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
80 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
81 1 . . . . . 3.8 1.8 3.8 parsed_1qtg 1
82 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
83 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
84 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
85 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
86 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
87 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
88 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
89 1 . . . . . 4.0 1.8 4.0 parsed_1qtg 1
90 1 . . . . . 4.0 1.8 4.0 parsed_1qtg 1
91 1 . . . . . 4.0 1.8 4.0 parsed_1qtg 1
92 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
93 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
94 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
95 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
96 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
97 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
98 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
99 1 . . . . . 6.0 1.8 6.0 parsed_1qtg 1
stop_
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 "*constraints from 3d noesy*" 100 1 100 1 parsed_1qtg 1
stop_
save_
save_MR_file_comment_4
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1qtg
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 4
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
###################################################################
# Chemical Shift Ambiguity Code Definitions #
# #
# Codes Definition #
# #
# 1 Unique #
# 2 Ambiguity of geminal atoms or geminal methyl #
# proton groups #
# 3 Aromatic atoms on opposite sides of the ring #
# (e.g. Tyr HE1 and HE2 protons) #
# 4 Intraresidue ambiguities (e.g. Lys HG and #
# HD protons) #
# 5 Interresidue ambiguities (Lys 12 vs. Lys 27) #
# 9 Ambiguous, specific ambiguity not defined #
# #
###################################################################
# INSTRUCTIONS
# 1) Replace the @-signs with appropriate values.
# 2) Text comments concerning the assignments can be
# supplied in the full deposition.
# 3) Feel free to add or delete rows to the table as needed.
# The row numbers (_Atom_shift_assign_ID values) will be
# re-assigned to sequential values by BMRB
;
save_
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