NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
|
|
497113 |
2k7w   |
cing | 2-parsed | STAR | distance | PRE | 54 |
data_2k7w_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k7w
_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_2k7w 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k7w
_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 2k7w "Master copy" parsed_2k7w
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k7w
_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 2k7w.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k7w 1
1 2k7w.mr . . HADDOCK 2 distance NOE ambi 0 parsed_2k7w 1
1 2k7w.mr . . XPLOR/CNS 3 distance PRE "Not applicable" 54 parsed_2k7w 1
1 2k7w.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k7w 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2k7w
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type PRE
_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_2k7w 1
2 1 . . . parsed_2k7w 1
3 1 . . . parsed_2k7w 1
4 1 . . . parsed_2k7w 1
5 1 . . . parsed_2k7w 1
6 1 . . . parsed_2k7w 1
7 1 . . . parsed_2k7w 1
8 1 . . . parsed_2k7w 1
9 1 . . . parsed_2k7w 1
10 1 . . . parsed_2k7w 1
11 1 . . . parsed_2k7w 1
12 1 . . . parsed_2k7w 1
13 1 . . . parsed_2k7w 1
14 1 . . . parsed_2k7w 1
15 1 . . . parsed_2k7w 1
16 1 . . . parsed_2k7w 1
17 1 . . . parsed_2k7w 1
18 1 . . . parsed_2k7w 1
19 1 . . . parsed_2k7w 1
20 1 . . . parsed_2k7w 1
21 1 . . . parsed_2k7w 1
22 1 . . . parsed_2k7w 1
23 1 . . . parsed_2k7w 1
24 1 . . . parsed_2k7w 1
25 1 . . . parsed_2k7w 1
26 1 . . . parsed_2k7w 1
27 1 . . . parsed_2k7w 1
28 1 . . . parsed_2k7w 1
29 1 . . . parsed_2k7w 1
30 1 . . . parsed_2k7w 1
31 1 . . . parsed_2k7w 1
32 1 . . . parsed_2k7w 1
33 1 . . . parsed_2k7w 1
34 1 . . . parsed_2k7w 1
35 1 . . . parsed_2k7w 1
36 1 . . . parsed_2k7w 1
37 1 . . . parsed_2k7w 1
38 1 . . . parsed_2k7w 1
39 1 . . . parsed_2k7w 1
40 1 . . . parsed_2k7w 1
41 1 . . . parsed_2k7w 1
42 1 . . . parsed_2k7w 1
43 1 . . . parsed_2k7w 1
44 1 . . . parsed_2k7w 1
45 1 . . . parsed_2k7w 1
46 1 . . . parsed_2k7w 1
47 1 . . . parsed_2k7w 1
48 1 . . . parsed_2k7w 1
49 1 . . . parsed_2k7w 1
50 1 . . . parsed_2k7w 1
51 1 . . . parsed_2k7w 1
52 1 . . . parsed_2k7w 1
53 1 . . . parsed_2k7w 1
54 1 . . . parsed_2k7w 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 . . . . . . . . B 20 . CB parsed_2k7w 1
1 1 2 . . . . . . . . A 14 . HN parsed_2k7w 1
2 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
2 1 2 . . . . . . . . A 15 . HN parsed_2k7w 1
3 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
3 1 2 . . . . . . . . A 16 . HN parsed_2k7w 1
4 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
4 1 2 . . . . . . . . A 17 . HN parsed_2k7w 1
5 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
5 1 2 . . . . . . . . A 20 . HN parsed_2k7w 1
6 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
6 1 2 . . . . . . . . A 21 . HN parsed_2k7w 1
7 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
7 1 2 . . . . . . . . A 24 . HN parsed_2k7w 1
8 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
8 1 2 . . . . . . . . A 25 . HN parsed_2k7w 1
9 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
9 1 2 . . . . . . . . A 28 . HN parsed_2k7w 1
10 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
10 1 2 . . . . . . . . A 30 . HN parsed_2k7w 1
11 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
11 1 2 . . . . . . . . A 31 . HN parsed_2k7w 1
12 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
12 1 2 . . . . . . . . A 33 . HN parsed_2k7w 1
13 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
13 1 2 . . . . . . . . A 34 . HN parsed_2k7w 1
14 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
14 1 2 . . . . . . . . A 36 . HN parsed_2k7w 1
15 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
15 1 2 . . . . . . . . A 38 . HN parsed_2k7w 1
16 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
16 1 2 . . . . . . . . A 39 . HN parsed_2k7w 1
17 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
17 1 2 . . . . . . . . A 41 . HN parsed_2k7w 1
18 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
18 1 2 . . . . . . . . A 42 . HN parsed_2k7w 1
19 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
19 1 2 . . . . . . . . A 44 . HN parsed_2k7w 1
20 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
20 1 2 . . . . . . . . A 46 . HN parsed_2k7w 1
21 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
21 1 2 . . . . . . . . A 47 . HN parsed_2k7w 1
22 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
22 1 2 . . . . . . . . A 48 . HN parsed_2k7w 1
23 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
23 1 2 . . . . . . . . A 52 . HN parsed_2k7w 1
24 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
24 1 2 . . . . . . . . A 53 . HN parsed_2k7w 1
25 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
25 1 2 . . . . . . . . A 54 . HN parsed_2k7w 1
26 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
26 1 2 . . . . . . . . A 55 . HN parsed_2k7w 1
27 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
27 1 2 . . . . . . . . A 57 . HN parsed_2k7w 1
28 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
28 1 2 . . . . . . . . A 142 . HN parsed_2k7w 1
29 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
29 1 2 . . . . . . . . A 147 . HN parsed_2k7w 1
30 1 1 . . . . . . . . B 20 . CB parsed_2k7w 1
30 1 2 . . . . . . . . A 150 . HN parsed_2k7w 1
31 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
31 1 2 . . . . . . . . A 20 . HN parsed_2k7w 1
32 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
32 1 2 . . . . . . . . A 24 . HN parsed_2k7w 1
33 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
33 1 2 . . . . . . . . A 25 . HN parsed_2k7w 1
34 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
34 1 2 . . . . . . . . A 85 . HN parsed_2k7w 1
35 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
35 1 2 . . . . . . . . A 89 . HN parsed_2k7w 1
36 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
36 1 2 . . . . . . . . A 90 . HN parsed_2k7w 1
37 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
37 1 2 . . . . . . . . A 93 . HN parsed_2k7w 1
38 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
38 1 2 . . . . . . . . A 97 . HN parsed_2k7w 1
39 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
39 1 2 . . . . . . . . A 131 . HN parsed_2k7w 1
40 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
40 1 2 . . . . . . . . A 132 . HN parsed_2k7w 1
41 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
41 1 2 . . . . . . . . A 134 . HN parsed_2k7w 1
42 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
42 1 2 . . . . . . . . A 135 . HN parsed_2k7w 1
43 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
43 1 2 . . . . . . . . A 136 . HN parsed_2k7w 1
44 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
44 1 2 . . . . . . . . A 137 . HN parsed_2k7w 1
45 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
45 1 2 . . . . . . . . A 139 . HN parsed_2k7w 1
46 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
46 1 2 . . . . . . . . A 141 . HN parsed_2k7w 1
47 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
47 1 2 . . . . . . . . A 142 . HN parsed_2k7w 1
48 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
48 1 2 . . . . . . . . A 143 . HN parsed_2k7w 1
49 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
49 1 2 . . . . . . . . A 144 . HN parsed_2k7w 1
50 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
50 1 2 . . . . . . . . A 146 . HN parsed_2k7w 1
51 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
51 1 2 . . . . . . . . A 147 . HN parsed_2k7w 1
52 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
52 1 2 . . . . . . . . A 149 . HN parsed_2k7w 1
53 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
53 1 2 . . . . . . . . A 150 . HN parsed_2k7w 1
54 1 1 . . . . . . . . B 3 . CB parsed_2k7w 1
54 1 2 . . . . . . . . A 152 . HN parsed_2k7w 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 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
2 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
3 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
4 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
5 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
6 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
7 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
8 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
9 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
10 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
11 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
12 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
13 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
14 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
15 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
16 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
17 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
18 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
19 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
20 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
21 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
22 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
23 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
24 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
25 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
26 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
27 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
28 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
29 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
30 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
31 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
32 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
33 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
34 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
35 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
36 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
37 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
38 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
39 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
40 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
41 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
42 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
43 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
44 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
45 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
46 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
47 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
48 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
49 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
50 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
51 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
52 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
53 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 1
54 1 . . . . . 25.00 1.80 25.00 parsed_2k7w 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
;
Unambiguous restraints of BAX-BIM BH3 helix derived from PRE and defined with upper bound distance of 25A from the CB atom
of each MTSL-derivatized residue of the BIM BH3 peptide
PRE derived constraints from A20C-MTSL
;
1 1 5 40 parsed_2k7w 1
2 "PRE derived constraints from W3C-MTSL" 36 1 36 39 parsed_2k7w 1
stop_
save_
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