NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
631692 |
5zb6   |
16864 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 42 |
data_5zb6_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5zb6
_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_5zb6 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5zb6
_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 5zb6 "Master copy" parsed_5zb6
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5zb6
_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 5zb6.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5zb6 1
1 5zb6.mr . . DYANA/DIANA 2 sequence "Not applicable" "Not applicable" 0 parsed_5zb6 1
1 5zb6.mr . . DYANA/DIANA 3 "dihedral angle" "Not applicable" "Not applicable" 102 parsed_5zb6 1
1 5zb6.mr . . DYANA/DIANA 4 distance NOE simple 1226 parsed_5zb6 1
1 5zb6.mr . . DYANA/DIANA 5 distance "hydrogen bond" simple 42 parsed_5zb6 1
1 5zb6.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5zb6 1
stop_
save_
save_DYANA/DIANA_distance_constraints_5
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_5zb6
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 5
_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_5zb6 1
2 1 . . . parsed_5zb6 1
3 1 . . . parsed_5zb6 1
4 1 . . . parsed_5zb6 1
5 1 . . . parsed_5zb6 1
6 1 . . . parsed_5zb6 1
7 1 . . . parsed_5zb6 1
8 1 . . . parsed_5zb6 1
9 1 . . . parsed_5zb6 1
10 1 . . . parsed_5zb6 1
11 1 . . . parsed_5zb6 1
12 1 . . . parsed_5zb6 1
13 1 . . . parsed_5zb6 1
14 1 . . . parsed_5zb6 1
15 1 . . . parsed_5zb6 1
16 1 . . . parsed_5zb6 1
17 1 . . . parsed_5zb6 1
18 1 . . . parsed_5zb6 1
19 1 . . . parsed_5zb6 1
20 1 . . . parsed_5zb6 1
21 1 . . . parsed_5zb6 1
22 1 . . . parsed_5zb6 1
23 1 . . . parsed_5zb6 1
24 1 . . . parsed_5zb6 1
25 1 . . . parsed_5zb6 1
26 1 . . . parsed_5zb6 1
27 1 . . . parsed_5zb6 1
28 1 . . . parsed_5zb6 1
29 1 . . . parsed_5zb6 1
30 1 . . . parsed_5zb6 1
31 1 . . . parsed_5zb6 1
32 1 . . . parsed_5zb6 1
33 1 . . . parsed_5zb6 1
34 1 . . . parsed_5zb6 1
35 1 . . . parsed_5zb6 1
36 1 . . . parsed_5zb6 1
37 1 . . . parsed_5zb6 1
38 1 . . . parsed_5zb6 1
39 1 . . . parsed_5zb6 1
40 1 . . . parsed_5zb6 1
41 1 . . . parsed_5zb6 1
42 1 . . . parsed_5zb6 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 . . . . . . . . . 35 ALA O parsed_5zb6 1
1 1 2 . . . . . . . . . 39 LYS H parsed_5zb6 1
2 1 1 . . . . . . . . . 35 ALA O parsed_5zb6 1
2 1 2 . . . . . . . . . 39 LYS N parsed_5zb6 1
3 1 1 . . . . . . . . . 36 ILE O parsed_5zb6 1
3 1 2 . . . . . . . . . 40 VAL H parsed_5zb6 1
4 1 1 . . . . . . . . . 36 ILE O parsed_5zb6 1
4 1 2 . . . . . . . . . 40 VAL N parsed_5zb6 1
5 1 1 . . . . . . . . . 37 LYS O parsed_5zb6 1
5 1 2 . . . . . . . . . 41 GLU H parsed_5zb6 1
6 1 1 . . . . . . . . . 37 LYS O parsed_5zb6 1
6 1 2 . . . . . . . . . 41 GLU N parsed_5zb6 1
7 1 1 . . . . . . . . . 91 LEU O parsed_5zb6 1
7 1 2 . . . . . . . . . 95 HIS H parsed_5zb6 1
8 1 1 . . . . . . . . . 91 LEU O parsed_5zb6 1
8 1 2 . . . . . . . . . 95 HIS N parsed_5zb6 1
9 1 1 . . . . . . . . . 92 VAL O parsed_5zb6 1
9 1 2 . . . . . . . . . 96 GLN H parsed_5zb6 1
10 1 1 . . . . . . . . . 92 VAL O parsed_5zb6 1
10 1 2 . . . . . . . . . 96 GLN N parsed_5zb6 1
11 1 1 . . . . . . . . . 93 LYS O parsed_5zb6 1
11 1 2 . . . . . . . . . 97 LEU H parsed_5zb6 1
12 1 1 . . . . . . . . . 93 LYS O parsed_5zb6 1
12 1 2 . . . . . . . . . 97 LEU N parsed_5zb6 1
13 1 1 . . . . . . . . . 94 ARG O parsed_5zb6 1
13 1 2 . . . . . . . . . 98 ILE H parsed_5zb6 1
14 1 1 . . . . . . . . . 94 ARG O parsed_5zb6 1
14 1 2 . . . . . . . . . 98 ILE N parsed_5zb6 1
15 1 1 . . . . . . . . . 104 ASP O parsed_5zb6 1
15 1 2 . . . . . . . . . 108 ALA H parsed_5zb6 1
16 1 1 . . . . . . . . . 104 ASP O parsed_5zb6 1
16 1 2 . . . . . . . . . 108 ALA N parsed_5zb6 1
17 1 1 . . . . . . . . . 105 GLU O parsed_5zb6 1
17 1 2 . . . . . . . . . 109 GLY H parsed_5zb6 1
18 1 1 . . . . . . . . . 105 GLU O parsed_5zb6 1
18 1 2 . . . . . . . . . 109 GLY N parsed_5zb6 1
19 1 1 . . . . . . . . . 48 HIS H parsed_5zb6 1
19 1 2 . . . . . . . . . 82 THR O parsed_5zb6 1
20 1 1 . . . . . . . . . 48 HIS N parsed_5zb6 1
20 1 2 . . . . . . . . . 82 THR O parsed_5zb6 1
21 1 1 . . . . . . . . . 48 HIS O parsed_5zb6 1
21 1 2 . . . . . . . . . 82 THR H parsed_5zb6 1
22 1 1 . . . . . . . . . 48 HIS O parsed_5zb6 1
22 1 2 . . . . . . . . . 82 THR N parsed_5zb6 1
23 1 1 . . . . . . . . . 50 LYS H parsed_5zb6 1
23 1 2 . . . . . . . . . 80 GLU H parsed_5zb6 1
24 1 1 . . . . . . . . . 50 LYS N parsed_5zb6 1
24 1 2 . . . . . . . . . 80 GLU N parsed_5zb6 1
25 1 1 . . . . . . . . . 50 LYS O parsed_5zb6 1
25 1 2 . . . . . . . . . 80 GLU O parsed_5zb6 1
26 1 1 . . . . . . . . . 50 LYS O parsed_5zb6 1
26 1 2 . . . . . . . . . 80 GLU O parsed_5zb6 1
27 1 1 . . . . . . . . . 52 ILE H parsed_5zb6 1
27 1 2 . . . . . . . . . 78 ARG O parsed_5zb6 1
28 1 1 . . . . . . . . . 52 ILE N parsed_5zb6 1
28 1 2 . . . . . . . . . 78 ARG O parsed_5zb6 1
29 1 1 . . . . . . . . . 52 ILE O parsed_5zb6 1
29 1 2 . . . . . . . . . 78 ARG H parsed_5zb6 1
30 1 1 . . . . . . . . . 52 ILE O parsed_5zb6 1
30 1 2 . . . . . . . . . 78 ARG N parsed_5zb6 1
31 1 1 . . . . . . . . . 77 PHE O parsed_5zb6 1
31 1 2 . . . . . . . . . 113 LEU H parsed_5zb6 1
32 1 1 . . . . . . . . . 77 PHE O parsed_5zb6 1
32 1 2 . . . . . . . . . 113 LEU N parsed_5zb6 1
33 1 1 . . . . . . . . . 79 LEU H parsed_5zb6 1
33 1 2 . . . . . . . . . 113 LEU O parsed_5zb6 1
34 1 1 . . . . . . . . . 79 LEU N parsed_5zb6 1
34 1 2 . . . . . . . . . 113 LEU O parsed_5zb6 1
35 1 1 . . . . . . . . . 79 LEU O parsed_5zb6 1
35 1 2 . . . . . . . . . 115 MET H parsed_5zb6 1
36 1 1 . . . . . . . . . 79 LEU O parsed_5zb6 1
36 1 2 . . . . . . . . . 115 MET N parsed_5zb6 1
37 1 1 . . . . . . . . . 81 VAL H parsed_5zb6 1
37 1 2 . . . . . . . . . 115 MET O parsed_5zb6 1
38 1 1 . . . . . . . . . 81 VAL N parsed_5zb6 1
38 1 2 . . . . . . . . . 115 MET O parsed_5zb6 1
39 1 1 . . . . . . . . . 81 VAL O parsed_5zb6 1
39 1 2 . . . . . . . . . 117 THR H parsed_5zb6 1
40 1 1 . . . . . . . . . 81 VAL O parsed_5zb6 1
40 1 2 . . . . . . . . . 117 THR N parsed_5zb6 1
41 1 1 . . . . . . . . . 82 THR H parsed_5zb6 1
41 1 2 . . . . . . . . . 117 THR O parsed_5zb6 1
42 1 1 . . . . . . . . . 82 THR N parsed_5zb6 1
42 1 2 . . . . . . . . . 117 THR O parsed_5zb6 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 . . . . . . . 2.3 parsed_5zb6 1
2 1 . . . . . . . 3.2 parsed_5zb6 1
3 1 . . . . . . . 2.1 parsed_5zb6 1
4 1 . . . . . . . 3 parsed_5zb6 1
5 1 . . . . . . . 2.4 parsed_5zb6 1
6 1 . . . . . . . 3.3 parsed_5zb6 1
7 1 . . . . . . . 2.4 parsed_5zb6 1
8 1 . . . . . . . 3.3 parsed_5zb6 1
9 1 . . . . . . . 2.1 parsed_5zb6 1
10 1 . . . . . . . 3 parsed_5zb6 1
11 1 . . . . . . . 2.12 parsed_5zb6 1
12 1 . . . . . . . 3 parsed_5zb6 1
13 1 . . . . . . . 2.3 parsed_5zb6 1
14 1 . . . . . . . 3.3 parsed_5zb6 1
15 1 . . . . . . . 2.8 parsed_5zb6 1
16 1 . . . . . . . 3.6 parsed_5zb6 1
17 1 . . . . . . . 2.4 parsed_5zb6 1
18 1 . . . . . . . 3.3 parsed_5zb6 1
19 1 . . . . . . . 2 parsed_5zb6 1
20 1 . . . . . . . 2.8 parsed_5zb6 1
21 1 . . . . . . . 2 parsed_5zb6 1
22 1 . . . . . . . 2.7 parsed_5zb6 1
23 1 . . . . . . . 3.2 parsed_5zb6 1
24 1 . . . . . . . 4.6 parsed_5zb6 1
25 1 . . . . . . . 3.4 parsed_5zb6 1
26 1 . . . . . . . 3.4 parsed_5zb6 1
27 1 . . . . . . . 2.2 parsed_5zb6 1
28 1 . . . . . . . 3.2 parsed_5zb6 1
29 1 . . . . . . . 2.4 parsed_5zb6 1
30 1 . . . . . . . 3.2 parsed_5zb6 1
31 1 . . . . . . . 2.5 parsed_5zb6 1
32 1 . . . . . . . 3.4 parsed_5zb6 1
33 1 . . . . . . . 2.4 parsed_5zb6 1
34 1 . . . . . . . 3.3 parsed_5zb6 1
35 1 . . . . . . . 2.2 parsed_5zb6 1
36 1 . . . . . . . 3.1 parsed_5zb6 1
37 1 . . . . . . . 2.5 parsed_5zb6 1
38 1 . . . . . . . 3.2 parsed_5zb6 1
39 1 . . . . . . . 2 parsed_5zb6 1
40 1 . . . . . . . 2.9 parsed_5zb6 1
41 1 . . . . . . . 5.2 parsed_5zb6 1
42 1 . . . . . . . 4.3 parsed_5zb6 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 "UVI31+, H-bond constraints" 1 1 1 27 parsed_5zb6 1
2 peak 2 57 2 62 parsed_5zb6 1
3 peak 3 57 3 61 parsed_5zb6 1
4 peak 4 57 4 62 parsed_5zb6 1
5 peak 5 57 5 62 parsed_5zb6 1
6 peak 6 57 6 62 parsed_5zb6 1
7 peak 7 57 7 62 parsed_5zb6 1
8 peak 8 57 8 62 parsed_5zb6 1
9 peak 9 57 9 62 parsed_5zb6 1
10 peak 10 57 10 62 parsed_5zb6 1
11 peak 11 57 11 62 parsed_5zb6 1
12 peak 12 57 12 61 parsed_5zb6 1
13 peak 13 57 13 61 parsed_5zb6 1
14 peak 14 57 14 61 parsed_5zb6 1
15 peak 15 57 15 61 parsed_5zb6 1
16 peak 16 57 16 61 parsed_5zb6 1
17 peak 17 57 17 61 parsed_5zb6 1
18 peak 18 57 18 61 parsed_5zb6 1
19 peak 19 57 19 61 parsed_5zb6 1
20 peak 20 57 20 61 parsed_5zb6 1
21 peak 21 57 21 61 parsed_5zb6 1
22 peak 22 57 22 61 parsed_5zb6 1
23 peak 23 57 23 61 parsed_5zb6 1
24 peak 24 57 24 61 parsed_5zb6 1
25 peak 25 57 25 61 parsed_5zb6 1
26 peak 26 57 26 61 parsed_5zb6 1
27 peak 27 57 27 61 parsed_5zb6 1
28 peak 28 57 28 61 parsed_5zb6 1
29 peak 29 57 29 61 parsed_5zb6 1
30 peak 30 57 30 61 parsed_5zb6 1
31 peak 31 57 31 61 parsed_5zb6 1
32 peak 32 57 32 61 parsed_5zb6 1
33 peak 33 57 33 61 parsed_5zb6 1
34 peak 34 57 34 61 parsed_5zb6 1
35 peak 35 57 35 61 parsed_5zb6 1
36 peak 36 57 36 61 parsed_5zb6 1
37 peak 37 57 37 61 parsed_5zb6 1
38 peak 38 57 38 61 parsed_5zb6 1
39 peak 39 57 39 61 parsed_5zb6 1
40 peak 40 57 40 61 parsed_5zb6 1
41 peak 41 57 41 61 parsed_5zb6 1
42 peak 42 57 42 61 parsed_5zb6 1
43 peak 43 57 43 61 parsed_5zb6 1
stop_
save_
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