NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
611870 |
5t82   |
30171 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 46 |
data_5t82_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5t82
_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_5t82 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5t82
_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 5t82 "Master copy" parsed_5t82
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5t82
_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 5t82.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5t82 1
1 5t82.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 46 parsed_5t82 1
1 5t82.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 116 parsed_5t82 1
1 5t82.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 46 parsed_5t82 1
1 5t82.mr . . XPLOR/CNS 5 distance NOE simple 0 parsed_5t82 1
1 5t82.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5t82 1
stop_
save_
save_CNS/XPLOR_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5t82
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 4
_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_5t82 1
2 1 . . . parsed_5t82 1
3 1 . . . parsed_5t82 1
4 1 . . . parsed_5t82 1
5 1 . . . parsed_5t82 1
6 1 . . . parsed_5t82 1
7 1 . . . parsed_5t82 1
8 1 . . . parsed_5t82 1
9 1 . . . parsed_5t82 1
10 1 . . . parsed_5t82 1
11 1 . . . parsed_5t82 1
12 1 . . . parsed_5t82 1
13 1 . . . parsed_5t82 1
14 1 . . . parsed_5t82 1
15 1 . . . parsed_5t82 1
16 1 . . . parsed_5t82 1
17 1 . . . parsed_5t82 1
18 1 . . . parsed_5t82 1
19 1 . . . parsed_5t82 1
20 1 . . . parsed_5t82 1
21 1 . . . parsed_5t82 1
22 1 . . . parsed_5t82 1
23 1 . . . parsed_5t82 1
24 1 . . . parsed_5t82 1
25 1 . . . parsed_5t82 1
26 1 . . . parsed_5t82 1
27 1 . . . parsed_5t82 1
28 1 . . . parsed_5t82 1
29 1 . . . parsed_5t82 1
30 1 . . . parsed_5t82 1
31 1 . . . parsed_5t82 1
32 1 . . . parsed_5t82 1
33 1 . . . parsed_5t82 1
34 1 . . . parsed_5t82 1
35 1 . . . parsed_5t82 1
36 1 . . . parsed_5t82 1
37 1 . . . parsed_5t82 1
38 1 . . . parsed_5t82 1
39 1 . . . parsed_5t82 1
40 1 . . . parsed_5t82 1
41 1 . . . parsed_5t82 1
42 1 . . . parsed_5t82 1
43 1 . . . parsed_5t82 1
44 1 . . . parsed_5t82 1
45 1 . . . parsed_5t82 1
46 1 . . . parsed_5t82 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 . . . . . . . . . 258 . HN parsed_5t82 1
1 1 2 . . . . . . . . . 254 . O parsed_5t82 1
2 1 1 . . . . . . . . . 259 . HN parsed_5t82 1
2 1 2 . . . . . . . . . 255 . O parsed_5t82 1
3 1 1 . . . . . . . . . 260 . HN parsed_5t82 1
3 1 2 . . . . . . . . . 256 . O parsed_5t82 1
4 1 1 . . . . . . . . . 261 . HN parsed_5t82 1
4 1 2 . . . . . . . . . 257 . O parsed_5t82 1
5 1 1 . . . . . . . . . 262 . HN parsed_5t82 1
5 1 2 . . . . . . . . . 258 . O parsed_5t82 1
6 1 1 . . . . . . . . . 263 . HN parsed_5t82 1
6 1 2 . . . . . . . . . 259 . O parsed_5t82 1
7 1 1 . . . . . . . . . 264 . HN parsed_5t82 1
7 1 2 . . . . . . . . . 260 . O parsed_5t82 1
8 1 1 . . . . . . . . . 265 . HN parsed_5t82 1
8 1 2 . . . . . . . . . 261 . O parsed_5t82 1
9 1 1 . . . . . . . . . 266 . HN parsed_5t82 1
9 1 2 . . . . . . . . . 262 . O parsed_5t82 1
10 1 1 . . . . . . . . . 267 . HN parsed_5t82 1
10 1 2 . . . . . . . . . 263 . O parsed_5t82 1
11 1 1 . . . . . . . . . 268 . HN parsed_5t82 1
11 1 2 . . . . . . . . . 264 . O parsed_5t82 1
12 1 1 . . . . . . . . . 269 . HN parsed_5t82 1
12 1 2 . . . . . . . . . 265 . O parsed_5t82 1
13 1 1 . . . . . . . . . 282 . HN parsed_5t82 1
13 1 2 . . . . . . . . . 278 . O parsed_5t82 1
14 1 1 . . . . . . . . . 301 . HN parsed_5t82 1
14 1 2 . . . . . . . . . 297 . O parsed_5t82 1
15 1 1 . . . . . . . . . 302 . HN parsed_5t82 1
15 1 2 . . . . . . . . . 298 . O parsed_5t82 1
16 1 1 . . . . . . . . . 303 . HN parsed_5t82 1
16 1 2 . . . . . . . . . 299 . O parsed_5t82 1
17 1 1 . . . . . . . . . 304 . HN parsed_5t82 1
17 1 2 . . . . . . . . . 300 . O parsed_5t82 1
18 1 1 . . . . . . . . . 305 . HN parsed_5t82 1
18 1 2 . . . . . . . . . 301 . O parsed_5t82 1
19 1 1 . . . . . . . . . 306 . HN parsed_5t82 1
19 1 2 . . . . . . . . . 302 . O parsed_5t82 1
20 1 1 . . . . . . . . . 307 . HN parsed_5t82 1
20 1 2 . . . . . . . . . 303 . O parsed_5t82 1
21 1 1 . . . . . . . . . 308 . HN parsed_5t82 1
21 1 2 . . . . . . . . . 304 . O parsed_5t82 1
22 1 1 . . . . . . . . . 309 . HN parsed_5t82 1
22 1 2 . . . . . . . . . 305 . O parsed_5t82 1
23 1 1 . . . . . . . . . 310 . HN parsed_5t82 1
23 1 2 . . . . . . . . . 306 . O parsed_5t82 1
24 1 1 . . . . . . . . . 258 . N parsed_5t82 1
24 1 2 . . . . . . . . . 254 . O parsed_5t82 1
25 1 1 . . . . . . . . . 259 . N parsed_5t82 1
25 1 2 . . . . . . . . . 255 . O parsed_5t82 1
26 1 1 . . . . . . . . . 260 . N parsed_5t82 1
26 1 2 . . . . . . . . . 256 . O parsed_5t82 1
27 1 1 . . . . . . . . . 261 . N parsed_5t82 1
27 1 2 . . . . . . . . . 257 . O parsed_5t82 1
28 1 1 . . . . . . . . . 262 . N parsed_5t82 1
28 1 2 . . . . . . . . . 258 . O parsed_5t82 1
29 1 1 . . . . . . . . . 263 . N parsed_5t82 1
29 1 2 . . . . . . . . . 259 . O parsed_5t82 1
30 1 1 . . . . . . . . . 264 . N parsed_5t82 1
30 1 2 . . . . . . . . . 260 . O parsed_5t82 1
31 1 1 . . . . . . . . . 265 . N parsed_5t82 1
31 1 2 . . . . . . . . . 261 . O parsed_5t82 1
32 1 1 . . . . . . . . . 266 . N parsed_5t82 1
32 1 2 . . . . . . . . . 262 . O parsed_5t82 1
33 1 1 . . . . . . . . . 267 . N parsed_5t82 1
33 1 2 . . . . . . . . . 263 . O parsed_5t82 1
34 1 1 . . . . . . . . . 268 . N parsed_5t82 1
34 1 2 . . . . . . . . . 264 . O parsed_5t82 1
35 1 1 . . . . . . . . . 269 . N parsed_5t82 1
35 1 2 . . . . . . . . . 265 . O parsed_5t82 1
36 1 1 . . . . . . . . . 282 . N parsed_5t82 1
36 1 2 . . . . . . . . . 278 . O parsed_5t82 1
37 1 1 . . . . . . . . . 301 . N parsed_5t82 1
37 1 2 . . . . . . . . . 297 . O parsed_5t82 1
38 1 1 . . . . . . . . . 302 . N parsed_5t82 1
38 1 2 . . . . . . . . . 298 . O parsed_5t82 1
39 1 1 . . . . . . . . . 303 . N parsed_5t82 1
39 1 2 . . . . . . . . . 299 . O parsed_5t82 1
40 1 1 . . . . . . . . . 304 . N parsed_5t82 1
40 1 2 . . . . . . . . . 300 . O parsed_5t82 1
41 1 1 . . . . . . . . . 305 . N parsed_5t82 1
41 1 2 . . . . . . . . . 301 . O parsed_5t82 1
42 1 1 . . . . . . . . . 306 . N parsed_5t82 1
42 1 2 . . . . . . . . . 302 . O parsed_5t82 1
43 1 1 . . . . . . . . . 307 . N parsed_5t82 1
43 1 2 . . . . . . . . . 303 . O parsed_5t82 1
44 1 1 . . . . . . . . . 308 . N parsed_5t82 1
44 1 2 . . . . . . . . . 304 . O parsed_5t82 1
45 1 1 . . . . . . . . . 309 . N parsed_5t82 1
45 1 2 . . . . . . . . . 305 . O parsed_5t82 1
46 1 1 . . . . . . . . . 310 . N parsed_5t82 1
46 1 2 . . . . . . . . . 306 . O parsed_5t82 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 . . . . . 2.0 1.8 2.3 parsed_5t82 1
2 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
3 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
4 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
5 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
6 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
7 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
8 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
9 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
10 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
11 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
12 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
13 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
14 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
15 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
16 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
17 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
18 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
19 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
20 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
21 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
22 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
23 1 . . . . . 2.0 1.8 2.3 parsed_5t82 1
24 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
25 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
26 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
27 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
28 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
29 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
30 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
31 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
32 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
33 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
34 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
35 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
36 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
37 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
38 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
39 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
40 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
41 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
42 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
43 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
44 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
45 1 . . . . . 3.0 2.7 3.3 parsed_5t82 1
46 1 . . . . . 3.0 2.7 3.3 parsed_5t82 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 "Hydrogen bond" 2 75 2 89 parsed_5t82 1
2 "Hydrogen bond" 3 75 3 90 parsed_5t82 1
3 "Hydrogen bond" 4 75 4 90 parsed_5t82 1
4 "Hydrogen bond" 5 75 5 90 parsed_5t82 1
5 "Hydrogen bond" 6 75 6 90 parsed_5t82 1
6 "Hydrogen bond" 7 75 7 90 parsed_5t82 1
7 "Hydrogen bond" 8 75 8 90 parsed_5t82 1
8 "Hydrogen bond" 9 75 9 90 parsed_5t82 1
9 "Hydrogen bond" 10 75 10 90 parsed_5t82 1
10 "Hydrogen bond" 11 75 11 90 parsed_5t82 1
11 "Hydrogen bond" 12 75 12 90 parsed_5t82 1
12 "Hydrogen bond" 13 75 13 91 parsed_5t82 1
13 "Hydrogen bond" 14 75 14 90 parsed_5t82 1
14 "Hydrogen bond" 15 75 15 90 parsed_5t82 1
15 "Hydrogen bond" 16 75 16 90 parsed_5t82 1
16 "Hydrogen bond" 17 75 17 90 parsed_5t82 1
17 "Hydrogen bond" 18 75 18 90 parsed_5t82 1
18 "Hydrogen bond" 19 75 19 90 parsed_5t82 1
19 "Hydrogen bond" 20 75 20 90 parsed_5t82 1
20 "Hydrogen bond" 21 75 21 90 parsed_5t82 1
21 "Hydrogen bond" 22 75 22 90 parsed_5t82 1
22 "Hydrogen bond" 23 75 23 90 parsed_5t82 1
23 "Hydrogen bond" 24 75 24 90 parsed_5t82 1
24 "Hydrogen bond" 25 74 25 88 parsed_5t82 1
25 "Hydrogen bond" 26 74 26 89 parsed_5t82 1
26 "Hydrogen bond" 27 74 27 89 parsed_5t82 1
27 "Hydrogen bond" 28 74 28 89 parsed_5t82 1
28 "Hydrogen bond" 29 74 29 89 parsed_5t82 1
29 "Hydrogen bond" 30 74 30 89 parsed_5t82 1
30 "Hydrogen bond" 31 74 31 89 parsed_5t82 1
31 "Hydrogen bond" 32 74 32 89 parsed_5t82 1
32 "Hydrogen bond" 33 74 33 89 parsed_5t82 1
33 "Hydrogen bond" 34 74 34 89 parsed_5t82 1
34 "Hydrogen bond" 35 74 35 89 parsed_5t82 1
35 "Hydrogen bond" 36 74 36 90 parsed_5t82 1
36 "Hydrogen bond" 37 74 37 89 parsed_5t82 1
37 "Hydrogen bond" 38 74 38 89 parsed_5t82 1
38 "Hydrogen bond" 39 74 39 89 parsed_5t82 1
39 "Hydrogen bond" 40 74 40 89 parsed_5t82 1
40 "Hydrogen bond" 41 74 41 89 parsed_5t82 1
41 "Hydrogen bond" 42 74 42 89 parsed_5t82 1
42 "Hydrogen bond" 43 74 43 89 parsed_5t82 1
43 "Hydrogen bond" 44 74 44 89 parsed_5t82 1
44 "Hydrogen bond" 45 74 45 89 parsed_5t82 1
45 "Hydrogen bond" 46 74 46 89 parsed_5t82 1
46 "Hydrogen bond" 47 74 47 89 parsed_5t82 1
stop_
loop_
_Dist_constraint_parse_err.ID
_Dist_constraint_parse_err.Content
_Dist_constraint_parse_err.Begin_line
_Dist_constraint_parse_err.Begin_column
_Dist_constraint_parse_err.End_line
_Dist_constraint_parse_err.End_column
_Dist_constraint_parse_err.Entry_ID
_Dist_constraint_parse_err.Distance_constraint_list_ID
1 "# Restraints file 3: 160906_3_NOE.tbl" 1 1 1 37 parsed_5t82 1
stop_
save_
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