NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
33188 |
1hue   |
4047 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 50 |
data_1hue_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1hue
_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_1hue 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1hue
_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 1hue "Master copy" parsed_1hue
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1hue
_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 1hue.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1hue 1
1 1hue.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1hue 1
1 1hue.mr . . DISCOVER 3 distance NOE simple 2490 parsed_1hue 1
1 1hue.mr . . DISCOVER 4 distance "hydrogen bond" simple 50 parsed_1hue 1
1 1hue.mr . . DISCOVER 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1hue 1
1 1hue.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1hue 1
stop_
save_
save_Discover_distance_constraints_4
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1hue
_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_1hue 1
2 1 . . . parsed_1hue 1
3 1 . . . parsed_1hue 1
4 1 . . . parsed_1hue 1
5 1 . . . parsed_1hue 1
6 1 . . . parsed_1hue 1
7 1 . . . parsed_1hue 1
8 1 . . . parsed_1hue 1
9 1 . . . parsed_1hue 1
10 1 . . . parsed_1hue 1
11 1 . . . parsed_1hue 1
12 1 . . . parsed_1hue 1
13 1 . . . parsed_1hue 1
14 1 . . . parsed_1hue 1
15 1 . . . parsed_1hue 1
16 1 . . . parsed_1hue 1
17 1 . . . parsed_1hue 1
18 1 . . . parsed_1hue 1
19 1 . . . parsed_1hue 1
20 1 . . . parsed_1hue 1
21 1 . . . parsed_1hue 1
22 1 . . . parsed_1hue 1
23 1 . . . parsed_1hue 1
24 1 . . . parsed_1hue 1
25 1 . . . parsed_1hue 1
26 1 . . . parsed_1hue 1
27 1 . . . parsed_1hue 1
28 1 . . . parsed_1hue 1
29 1 . . . parsed_1hue 1
30 1 . . . parsed_1hue 1
31 1 . . . parsed_1hue 1
32 1 . . . parsed_1hue 1
33 1 . . . parsed_1hue 1
34 1 . . . parsed_1hue 1
35 1 . . . parsed_1hue 1
36 1 . . . parsed_1hue 1
37 1 . . . parsed_1hue 1
38 1 . . . parsed_1hue 1
39 1 . . . parsed_1hue 1
40 1 . . . parsed_1hue 1
41 1 . . . parsed_1hue 1
42 1 . . . parsed_1hue 1
43 1 . . . parsed_1hue 1
44 1 . . . parsed_1hue 1
45 1 . . . parsed_1hue 1
46 1 . . . parsed_1hue 1
47 1 . . . parsed_1hue 1
48 1 . . . parsed_1hue 1
49 1 . . . parsed_1hue 1
50 1 . . . parsed_1hue 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 . . . . . . . . 1 4 THR O parsed_1hue 1
1 1 2 . . . . . . . . 1 8 ASN HN parsed_1hue 1
2 1 1 . . . . . . . . 1 94 THR O parsed_1hue 1
2 1 2 . . . . . . . . 1 98 ASN HN parsed_1hue 1
3 1 1 . . . . . . . . 1 6 LEU O parsed_1hue 1
3 1 2 . . . . . . . . 1 10 VAL HN parsed_1hue 1
4 1 1 . . . . . . . . 1 96 LEU O parsed_1hue 1
4 1 2 . . . . . . . . 1 100 VAL HN parsed_1hue 1
5 1 1 . . . . . . . . 1 7 ILE O parsed_1hue 1
5 1 2 . . . . . . . . 1 11 ALA HN parsed_1hue 1
6 1 1 . . . . . . . . 1 97 ILE O parsed_1hue 1
6 1 2 . . . . . . . . 1 101 ALA HN parsed_1hue 1
7 1 1 . . . . . . . . 1 9 ALA O parsed_1hue 1
7 1 2 . . . . . . . . 1 13 THR HN parsed_1hue 1
8 1 1 . . . . . . . . 1 99 ALA O parsed_1hue 1
8 1 2 . . . . . . . . 1 103 THR HN parsed_1hue 1
9 1 1 . . . . . . . . 1 17 SER O parsed_1hue 1
9 1 2 . . . . . . . . 1 21 ALA HN parsed_1hue 1
10 1 1 . . . . . . . . 1 107 SER O parsed_1hue 1
10 1 2 . . . . . . . . 1 111 ALA HN parsed_1hue 1
11 1 1 . . . . . . . . 1 18 LYS O parsed_1hue 1
11 1 2 . . . . . . . . 1 22 THR HN parsed_1hue 1
12 1 1 . . . . . . . . 1 108 LYS O parsed_1hue 1
12 1 2 . . . . . . . . 1 112 THR HN parsed_1hue 1
13 1 1 . . . . . . . . 1 20 ASP O parsed_1hue 1
13 1 2 . . . . . . . . 1 24 ALA HN parsed_1hue 1
14 1 1 . . . . . . . . 1 110 ASP O parsed_1hue 1
14 1 2 . . . . . . . . 1 114 ALA HN parsed_1hue 1
15 1 1 . . . . . . . . 1 21 ALA O parsed_1hue 1
15 1 2 . . . . . . . . 1 25 VAL HN parsed_1hue 1
16 1 1 . . . . . . . . 1 111 ALA O parsed_1hue 1
16 1 2 . . . . . . . . 1 115 VAL HN parsed_1hue 1
17 1 1 . . . . . . . . 1 22 THR O parsed_1hue 1
17 1 2 . . . . . . . . 1 26 ASP HN parsed_1hue 1
18 1 1 . . . . . . . . 1 112 THR O parsed_1hue 1
18 1 2 . . . . . . . . 1 116 ASP HN parsed_1hue 1
19 1 1 . . . . . . . . 1 25 VAL O parsed_1hue 1
19 1 2 . . . . . . . . 1 29 PHE HN parsed_1hue 1
20 1 1 . . . . . . . . 1 115 VAL O parsed_1hue 1
20 1 2 . . . . . . . . 1 119 PHE HN parsed_1hue 1
21 1 1 . . . . . . . . 1 28 VAL O parsed_1hue 1
21 1 2 . . . . . . . . 1 32 ILE HN parsed_1hue 1
22 1 1 . . . . . . . . 1 118 VAL O parsed_1hue 1
22 1 2 . . . . . . . . 1 122 ILE HN parsed_1hue 1
23 1 1 . . . . . . . . 1 32 ILE O parsed_1hue 1
23 1 2 . . . . . . . . 1 36 LEU HN parsed_1hue 1
24 1 1 . . . . . . . . 1 122 ILE O parsed_1hue 1
24 1 2 . . . . . . . . 1 126 LEU HN parsed_1hue 1
25 1 1 . . . . . . . . 1 33 THR O parsed_1hue 1
25 1 2 . . . . . . . . 1 37 ARG HN parsed_1hue 1
26 1 1 . . . . . . . . 1 123 THR O parsed_1hue 1
26 1 2 . . . . . . . . 1 127 ARG HN parsed_1hue 1
27 1 1 . . . . . . . . 1 35 ALA O parsed_1hue 1
27 1 2 . . . . . . . . 1 38 LYS HN parsed_1hue 1
28 1 1 . . . . . . . . 1 125 ALA O parsed_1hue 1
28 1 2 . . . . . . . . 1 128 LYS HN parsed_1hue 1
29 1 1 . . . . . . . . 1 35 ALA O parsed_1hue 1
29 1 2 . . . . . . . . 1 40 ASP HN parsed_1hue 1
30 1 1 . . . . . . . . 1 125 ALA O parsed_1hue 1
30 1 2 . . . . . . . . 1 130 ASP HN parsed_1hue 1
31 1 1 . . . . . . . . 1 50 PHE O parsed_1hue 1
31 1 2 . . . . . . . . 1 42 VAL HN parsed_1hue 1
32 1 1 . . . . . . . . 1 140 PHE O parsed_1hue 1
32 1 2 . . . . . . . . 1 132 VAL HN parsed_1hue 1
33 1 1 . . . . . . . . 1 48 GLY O parsed_1hue 1
33 1 2 . . . . . . . . 1 44 LEU HN parsed_1hue 1
34 1 1 . . . . . . . . 1 138 GLY O parsed_1hue 1
34 1 2 . . . . . . . . 1 134 LEU HN parsed_1hue 1
35 1 1 . . . . . . . . 1 44 LEU O parsed_1hue 1
35 1 2 . . . . . . . . 1 48 GLY HN parsed_1hue 1
36 1 1 . . . . . . . . 1 134 LEU O parsed_1hue 1
36 1 2 . . . . . . . . 1 138 GLY HN parsed_1hue 1
37 1 1 . . . . . . . . 1 80 LYS O parsed_1hue 1
37 1 2 . . . . . . . . 1 49 ASN HN parsed_1hue 1
38 1 1 . . . . . . . . 1 170 LYS O parsed_1hue 1
38 1 2 . . . . . . . . 1 139 ASN HN parsed_1hue 1
39 1 1 . . . . . . . . 1 78 ALA O parsed_1hue 1
39 1 2 . . . . . . . . 1 51 GLU HN parsed_1hue 1
40 1 1 . . . . . . . . 1 168 ALA O parsed_1hue 1
40 1 2 . . . . . . . . 1 141 GLU HN parsed_1hue 1
41 1 1 . . . . . . . . 1 49 ASN O parsed_1hue 1
41 1 2 . . . . . . . . 1 80 LYS HN parsed_1hue 1
42 1 1 . . . . . . . . 1 139 ASN O parsed_1hue 1
42 1 2 . . . . . . . . 1 170 LYS HN parsed_1hue 1
43 1 1 . . . . . . . . 1 82 GLY O parsed_1hue 1
43 1 2 . . . . . . . . 1 84 ALA HN parsed_1hue 1
44 1 1 . . . . . . . . 1 172 GLY O parsed_1hue 1
44 1 2 . . . . . . . . 1 174 ALA HN parsed_1hue 1
45 1 1 . . . . . . . . 1 81 PRO O parsed_1hue 1
45 1 2 . . . . . . . . 1 85 LEU HN parsed_1hue 1
46 1 1 . . . . . . . . 1 171 PRO O parsed_1hue 1
46 1 2 . . . . . . . . 1 175 LEU HN parsed_1hue 1
47 1 1 . . . . . . . . 1 84 ALA O parsed_1hue 1
47 1 2 . . . . . . . . 1 88 ALA HN parsed_1hue 1
48 1 1 . . . . . . . . 1 174 ALA O parsed_1hue 1
48 1 2 . . . . . . . . 1 178 ALA HN parsed_1hue 1
49 1 1 . . . . . . . . 1 85 LEU O parsed_1hue 1
49 1 2 . . . . . . . . 1 89 VAL HN parsed_1hue 1
50 1 1 . . . . . . . . 1 175 LEU O parsed_1hue 1
50 1 2 . . . . . . . . 1 179 VAL HN parsed_1hue 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 . . . . . 2.310 1.800 2.310 parsed_1hue 1
2 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
3 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
4 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
5 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
6 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
7 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
8 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
9 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
10 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
11 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
12 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
13 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
14 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
15 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
16 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
17 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
18 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
19 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
20 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
21 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
22 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
23 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
24 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
25 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
26 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
27 1 . . . . . 2.500 1.800 2.500 parsed_1hue 1
28 1 . . . . . 2.500 1.800 2.500 parsed_1hue 1
29 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
30 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
31 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
32 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
33 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
34 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
35 1 . . . . . 2.500 1.800 2.500 parsed_1hue 1
36 1 . . . . . 2.500 1.800 2.500 parsed_1hue 1
37 1 . . . . . 2.500 1.800 2.500 parsed_1hue 1
38 1 . . . . . 2.500 1.800 2.500 parsed_1hue 1
39 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
40 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
41 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
42 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
43 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
44 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
45 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
46 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
47 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
48 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
49 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
50 1 . . . . . 2.310 1.800 2.310 parsed_1hue 1
stop_
save_
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