NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
543757 |
2yka   |
17693 | cing | 2-parsed | STAR | distance | NOE | simple | 62 |
data_2yka_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2yka
_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_2yka 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2yka
_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 2yka "Master copy" parsed_2yka
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2yka
_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 2yka.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2yka 1
1 2yka.mr . . XEASY 2 peak "Not applicable" "Not applicable" 0 parsed_2yka 1
1 2yka.mr . . DYANA/DIANA 3 distance NOE simple 62 parsed_2yka 1
1 2yka.mr . . DYANA/DIANA 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2yka 1
1 2yka.mr . . XEASY 5 "chemical shift" "Not applicable" "Not applicable" 0 parsed_2yka 1
1 2yka.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2yka 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2yka
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_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_2yka 1
2 1 . . . parsed_2yka 1
3 1 . . . parsed_2yka 1
4 1 . . . parsed_2yka 1
5 1 . . . parsed_2yka 1
6 1 . . . parsed_2yka 1
7 1 . . . parsed_2yka 1
8 1 . . . parsed_2yka 1
9 1 . . . parsed_2yka 1
10 1 . . . parsed_2yka 1
11 1 . . . parsed_2yka 1
12 1 . . . parsed_2yka 1
13 1 . . . parsed_2yka 1
14 1 . . . parsed_2yka 1
15 1 . . . parsed_2yka 1
16 1 . . . parsed_2yka 1
17 1 . . . parsed_2yka 1
18 1 . . . parsed_2yka 1
19 1 . . . parsed_2yka 1
20 1 . . . parsed_2yka 1
21 1 . . . parsed_2yka 1
22 1 . . . parsed_2yka 1
23 1 . . . parsed_2yka 1
24 1 . . . parsed_2yka 1
25 1 . . . parsed_2yka 1
26 1 . . . parsed_2yka 1
27 1 . . . parsed_2yka 1
28 1 . . . parsed_2yka 1
29 1 . . . parsed_2yka 1
30 1 . . . parsed_2yka 1
31 1 . . . parsed_2yka 1
32 1 . . . parsed_2yka 1
33 1 . . . parsed_2yka 1
34 1 . . . parsed_2yka 1
35 1 . . . parsed_2yka 1
36 1 . . . parsed_2yka 1
37 1 . . . parsed_2yka 1
38 1 . . . parsed_2yka 1
39 1 . . . parsed_2yka 1
40 1 . . . parsed_2yka 1
41 1 . . . parsed_2yka 1
42 1 . . . parsed_2yka 1
43 1 . . . parsed_2yka 1
44 1 . . . parsed_2yka 1
45 1 . . . parsed_2yka 1
46 1 . . . parsed_2yka 1
47 1 . . . parsed_2yka 1
48 1 . . . parsed_2yka 1
49 1 . . . parsed_2yka 1
50 1 . . . parsed_2yka 1
51 1 . . . parsed_2yka 1
52 1 . . . parsed_2yka 1
53 1 . . . parsed_2yka 1
54 1 . . . parsed_2yka 1
55 1 . . . parsed_2yka 1
56 1 . . . parsed_2yka 1
57 1 . . . parsed_2yka 1
58 1 . . . parsed_2yka 1
59 1 . . . parsed_2yka 1
60 1 . . . parsed_2yka 1
61 1 . . . parsed_2yka 1
62 1 . . . parsed_2yka 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 . . . . . . . . . 82 LEU HD2 parsed_2yka 1
1 1 2 . . . . . . . . . 208 TRP HZ2 parsed_2yka 1
2 1 1 . . . . . . . . . 82 LEU HD1 parsed_2yka 1
2 1 2 . . . . . . . . . 208 TRP HH2 parsed_2yka 1
3 1 1 . . . . . . . . . 82 LEU HD1 parsed_2yka 1
3 1 2 . . . . . . . . . 208 TRP HZ2 parsed_2yka 1
4 1 1 . . . . . . . . . 86 VAL H parsed_2yka 1
4 1 2 . . . . . . . . . 208 TRP HH2 parsed_2yka 1
5 1 1 . . . . . . . . . 86 VAL H parsed_2yka 1
5 1 2 . . . . . . . . . 208 TRP HZ2 parsed_2yka 1
6 1 1 . . . . . . . . . 86 VAL HG1 parsed_2yka 1
6 1 2 . . . . . . . . . 208 TRP HH2 parsed_2yka 1
7 1 1 . . . . . . . . . 86 VAL HG1 parsed_2yka 1
7 1 2 . . . . . . . . . 208 TRP HZ2 parsed_2yka 1
8 1 1 . . . . . . . . . 86 VAL HG2 parsed_2yka 1
8 1 2 . . . . . . . . . 208 TRP HH2 parsed_2yka 1
9 1 1 . . . . . . . . . 91 ILE HD1 parsed_2yka 1
9 1 2 . . . . . . . . . 208 TRP HZ3 parsed_2yka 1
10 1 1 . . . . . . . . . 93 GLU HA parsed_2yka 1
10 1 2 . . . . . . . . . 209 ALA HB parsed_2yka 1
11 1 1 . . . . . . . . . 93 GLU HB2 parsed_2yka 1
11 1 2 . . . . . . . . . 209 ALA HB parsed_2yka 1
12 1 1 . . . . . . . . . 93 GLU HB3 parsed_2yka 1
12 1 2 . . . . . . . . . 209 ALA HB parsed_2yka 1
13 1 1 . . . . . . . . . 93 GLU HG2 parsed_2yka 1
13 1 2 . . . . . . . . . 209 ALA HB parsed_2yka 1
14 1 1 . . . . . . . . . 93 GLU HG3 parsed_2yka 1
14 1 2 . . . . . . . . . 209 ALA HB parsed_2yka 1
15 1 1 . . . . . . . . . 94 LEU H parsed_2yka 1
15 1 2 . . . . . . . . . 208 TRP HZ3 parsed_2yka 1
16 1 1 . . . . . . . . . 94 LEU HA parsed_2yka 1
16 1 2 . . . . . . . . . 209 ALA HB parsed_2yka 1
17 1 1 . . . . . . . . . 94 LEU HD1 parsed_2yka 1
17 1 2 . . . . . . . . . 209 ALA HB parsed_2yka 1
18 1 1 . . . . . . . . . 94 LEU HD1 parsed_2yka 1
18 1 2 . . . . . . . . . 213 ARG HG3 parsed_2yka 1
19 1 1 . . . . . . . . . 94 LEU HD1 parsed_2yka 1
19 1 2 . . . . . . . . . 213 ARG HG2 parsed_2yka 1
20 1 1 . . . . . . . . . 94 LEU HD1 parsed_2yka 1
20 1 2 . . . . . . . . . 213 ARG HD2 parsed_2yka 1
21 1 1 . . . . . . . . . 94 LEU HD1 parsed_2yka 1
21 1 2 . . . . . . . . . 213 ARG H parsed_2yka 1
22 1 1 . . . . . . . . . 94 LEU HD1 parsed_2yka 1
22 1 2 . . . . . . . . . 208 TRP HH2 parsed_2yka 1
23 1 1 . . . . . . . . . 94 LEU HD1 parsed_2yka 1
23 1 2 . . . . . . . . . 208 TRP HZ3 parsed_2yka 1
24 1 1 . . . . . . . . . 94 LEU HD2 parsed_2yka 1
24 1 2 . . . . . . . . . 209 ALA HB parsed_2yka 1
25 1 1 . . . . . . . . . 94 LEU HD2 parsed_2yka 1
25 1 2 . . . . . . . . . 208 TRP HH2 parsed_2yka 1
26 1 1 . . . . . . . . . 94 LEU HD2 parsed_2yka 1
26 1 2 . . . . . . . . . 208 TRP HZ3 parsed_2yka 1
27 1 1 . . . . . . . . . 140 LEU HA parsed_2yka 1
27 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
28 1 1 . . . . . . . . . 140 LEU HD1 parsed_2yka 1
28 1 2 . . . . . . . . . 211 ARG HG3 parsed_2yka 1
29 1 1 . . . . . . . . . 140 LEU HD1 parsed_2yka 1
29 1 2 . . . . . . . . . 211 ARG HB2 parsed_2yka 1
30 1 1 . . . . . . . . . 140 LEU HD1 parsed_2yka 1
30 1 2 . . . . . . . . . 211 ARG HD3 parsed_2yka 1
31 1 1 . . . . . . . . . 140 LEU HD1 parsed_2yka 1
31 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
32 1 1 . . . . . . . . . 140 LEU HD2 parsed_2yka 1
32 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
33 1 1 . . . . . . . . . 140 LEU HD1 parsed_2yka 1
33 1 2 . . . . . . . . . 216 ALA HB parsed_2yka 1
34 1 1 . . . . . . . . . 140 LEU HD2 parsed_2yka 1
34 1 2 . . . . . . . . . 211 ARG HG3 parsed_2yka 1
35 1 1 . . . . . . . . . 140 LEU HD2 parsed_2yka 1
35 1 2 . . . . . . . . . 211 ARG HB2 parsed_2yka 1
36 1 1 . . . . . . . . . 140 LEU HD2 parsed_2yka 1
36 1 2 . . . . . . . . . 211 ARG HD3 parsed_2yka 1
37 1 1 . . . . . . . . . 140 LEU HD1 parsed_2yka 1
37 1 2 . . . . . . . . . 208 TRP HD1 parsed_2yka 1
38 1 1 . . . . . . . . . 140 LEU HD2 parsed_2yka 1
38 1 2 . . . . . . . . . 208 TRP HZ2 parsed_2yka 1
39 1 1 . . . . . . . . . 140 LEU HD2 parsed_2yka 1
39 1 2 . . . . . . . . . 208 TRP HE1 parsed_2yka 1
40 1 1 . . . . . . . . . 138 VAL HA parsed_2yka 1
40 1 2 . . . . . . . . . 219 ARG HD2 parsed_2yka 1
41 1 1 . . . . . . . . . 138 VAL HA parsed_2yka 1
41 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
42 1 1 . . . . . . . . . 138 VAL HB parsed_2yka 1
42 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
43 1 1 . . . . . . . . . 138 VAL HG1 parsed_2yka 1
43 1 2 . . . . . . . . . 216 ALA HA parsed_2yka 1
44 1 1 . . . . . . . . . 138 VAL HG1 parsed_2yka 1
44 1 2 . . . . . . . . . 216 ALA HB parsed_2yka 1
45 1 1 . . . . . . . . . 138 VAL HG1 parsed_2yka 1
45 1 2 . . . . . . . . . 219 ARG HD2 parsed_2yka 1
46 1 1 . . . . . . . . . 138 VAL HG2 parsed_2yka 1
46 1 2 . . . . . . . . . 219 ARG HD2 parsed_2yka 1
47 1 1 . . . . . . . . . 138 VAL HG1 parsed_2yka 1
47 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
48 1 1 . . . . . . . . . 138 VAL HG2 parsed_2yka 1
48 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
49 1 1 . . . . . . . . . 138 VAL HG2 parsed_2yka 1
49 1 2 . . . . . . . . . 216 ALA HA parsed_2yka 1
50 1 1 . . . . . . . . . 139 PRO HD2 parsed_2yka 1
50 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
51 1 1 . . . . . . . . . 139 PRO HD2 parsed_2yka 1
51 1 2 . . . . . . . . . 219 ARG HD2 parsed_2yka 1
52 1 1 . . . . . . . . . 139 PRO HD3 parsed_2yka 1
52 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
53 1 1 . . . . . . . . . 139 PRO HD3 parsed_2yka 1
53 1 2 . . . . . . . . . 219 ARG HD2 parsed_2yka 1
54 1 1 . . . . . . . . . 145 MET HE parsed_2yka 1
54 1 2 . . . . . . . . . 215 ALA HB parsed_2yka 1
55 1 1 . . . . . . . . . 145 MET HE parsed_2yka 1
55 1 2 . . . . . . . . . 212 VAL HG2 parsed_2yka 1
56 1 1 . . . . . . . . . 209 ALA HB parsed_2yka 1
56 1 2 . . . . . . . . . 208 TRP HZ3 parsed_2yka 1
57 1 1 . . . . . . . . . 209 ALA HB parsed_2yka 1
57 1 2 . . . . . . . . . 208 TRP HE3 parsed_2yka 1
58 1 1 . . . . . . . . . 94 LEU HD2 parsed_2yka 1
58 1 2 . . . . . . . . . 212 VAL HG1 parsed_2yka 1
59 1 1 . . . . . . . . . 135 TYR HE1 parsed_2yka 1
59 1 2 . . . . . . . . . 217 ALA HB parsed_2yka 1
60 1 1 . . . . . . . . . 82 LEU HD1 parsed_2yka 1
60 1 2 . . . . . . . . . 208 TRP HE1 parsed_2yka 1
61 1 1 . . . . . . . . . 86 VAL HG1 parsed_2yka 1
61 1 2 . . . . . . . . . 208 TRP HE1 parsed_2yka 1
62 1 1 . . . . . . . . . 98 PHE HE1 parsed_2yka 1
62 1 2 . . . . . . . . . 145 MET HE parsed_2yka 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 . . . . . . . 5.5 parsed_2yka 1
2 1 . . . . . . . 5.5 parsed_2yka 1
3 1 . . . . . . . 5.5 parsed_2yka 1
4 1 . . . . . . . 5.5 parsed_2yka 1
5 1 . . . . . . . 5.5 parsed_2yka 1
6 1 . . . . . . . 5.5 parsed_2yka 1
7 1 . . . . . . . 5.5 parsed_2yka 1
8 1 . . . . . . . 5.0 parsed_2yka 1
9 1 . . . . . . . 5.5 parsed_2yka 1
10 1 . . . . . . . 5.5 parsed_2yka 1
11 1 . . . . . . . 5.0 parsed_2yka 1
12 1 . . . . . . . 5.0 parsed_2yka 1
13 1 . . . . . . . 4.0 parsed_2yka 1
14 1 . . . . . . . 4.0 parsed_2yka 1
15 1 . . . . . . . 5.5 parsed_2yka 1
16 1 . . . . . . . 4.0 parsed_2yka 1
17 1 . . . . . . . 4.0 parsed_2yka 1
18 1 . . . . . . . 5.0 parsed_2yka 1
19 1 . . . . . . . 5.5 parsed_2yka 1
20 1 . . . . . . . 5.5 parsed_2yka 1
21 1 . . . . . . . 5.5 parsed_2yka 1
22 1 . . . . . . . 5.5 parsed_2yka 1
23 1 . . . . . . . 5.5 parsed_2yka 1
24 1 . . . . . . . 5.5 parsed_2yka 1
25 1 . . . . . . . 5.5 parsed_2yka 1
26 1 . . . . . . . 5.5 parsed_2yka 1
27 1 . . . . . . . 5.5 parsed_2yka 1
28 1 . . . . . . . 4.5 parsed_2yka 1
29 1 . . . . . . . 4.5 parsed_2yka 1
30 1 . . . . . . . 5.5 parsed_2yka 1
31 1 . . . . . . . 4.5 parsed_2yka 1
32 1 . . . . . . . 5.0 parsed_2yka 1
33 1 . . . . . . . 5.5 parsed_2yka 1
34 1 . . . . . . . 4.5 parsed_2yka 1
35 1 . . . . . . . 5.0 parsed_2yka 1
36 1 . . . . . . . 5.5 parsed_2yka 1
37 1 . . . . . . . 5.5 parsed_2yka 1
38 1 . . . . . . . 4.5 parsed_2yka 1
39 1 . . . . . . . 4.5 parsed_2yka 1
40 1 . . . . . . . 5.5 parsed_2yka 1
41 1 . . . . . . . 5.5 parsed_2yka 1
42 1 . . . . . . . 5.5 parsed_2yka 1
43 1 . . . . . . . 4.5 parsed_2yka 1
44 1 . . . . . . . 5.5 parsed_2yka 1
45 1 . . . . . . . 5.0 parsed_2yka 1
46 1 . . . . . . . 5.5 parsed_2yka 1
47 1 . . . . . . . 4.5 parsed_2yka 1
48 1 . . . . . . . 4.0 parsed_2yka 1
49 1 . . . . . . . 5.0 parsed_2yka 1
50 1 . . . . . . . 5.5 parsed_2yka 1
51 1 . . . . . . . 5.5 parsed_2yka 1
52 1 . . . . . . . 5.5 parsed_2yka 1
53 1 . . . . . . . 5.5 parsed_2yka 1
54 1 . . . . . . . 5.5 parsed_2yka 1
55 1 . . . . . . . 5.5 parsed_2yka 1
56 1 . . . . . . . 5.5 parsed_2yka 1
57 1 . . . . . . . 5.5 parsed_2yka 1
58 1 . . . . . . . 4.5 parsed_2yka 1
59 1 . . . . . . . 5.5 parsed_2yka 1
60 1 . . . . . . . 5.5 parsed_2yka 1
61 1 . . . . . . . 5.5 parsed_2yka 1
62 1 . . . . . . . 5.0 parsed_2yka 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 "R211 and R213 swapping good" 1 1 1 28 parsed_2yka 1
2 "W208 exchanging assignment" 2 1 2 27 parsed_2yka 1
3 new 4 28 4 31 parsed_2yka 1
4 new 5 28 5 31 parsed_2yka 1
5 new 6 28 6 31 parsed_2yka 1
6 new 7 28 7 31 parsed_2yka 1
7 new 8 28 8 31 parsed_2yka 1
8 new 9 28 9 31 parsed_2yka 1
9 "86 VAL HG2 208 TRP HZ2 4.5 #new" 10 1 10 32 parsed_2yka 1
10 new 11 28 11 31 parsed_2yka 1
11 new 12 28 12 31 parsed_2yka 1
12 new 18 27 18 30 parsed_2yka 1
13 new 25 28 25 31 parsed_2yka 1
14 new 26 28 26 31 parsed_2yka 1
15 new 28 28 28 31 parsed_2yka 1
16 new 29 28 29 31 parsed_2yka 1
17 new 40 29 40 32 parsed_2yka 1
18 new 41 29 41 32 parsed_2yka 1
19 new 46 29 46 32 parsed_2yka 1
20 new 52 29 52 32 parsed_2yka 1
21 . 54 29 54 30 parsed_2yka 1
22 . 56 29 56 30 parsed_2yka 1
23 Possible... 65 1 65 12 parsed_2yka 1
24 "142 GLY H 208 TRP HE1 5.5" 69 1 69 26 parsed_2yka 1
25 new 70 27 70 30 parsed_2yka 1
26 "salt bridge???" 72 1 72 15 parsed_2yka 1
27 "91 ILE HG2 211 ARG HE 5.5" 73 1 73 26 parsed_2yka 1
28 "97 GLU OE1 213 ARG HH21 4.5 #new" 74 1 74 33 parsed_2yka 1
stop_
save_
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