NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
563745 |
2m6y   |
19163 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 50 |
data_2m6y_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2m6y
_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_2m6y 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2m6y
_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 2m6y "Master copy" parsed_2m6y
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2m6y
_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 2m6y.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2m6y 1
1 2m6y.mr . . XPLOR/CNS 2 distance NOE simple 1057 parsed_2m6y 1
1 2m6y.mr . . XPLOR/CNS 3 unknown "Not applicable" "Not applicable" 0 parsed_2m6y 1
1 2m6y.mr . . XPLOR/CNS 4 unknown "Not applicable" "Not applicable" 0 parsed_2m6y 1
1 2m6y.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 116 parsed_2m6y 1
1 2m6y.mr . . XPLOR/CNS 6 distance "hydrogen bond" simple 50 parsed_2m6y 1
1 2m6y.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2m6y 1
stop_
save_
save_CNS/XPLOR_distance_constraints_6
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2m6y
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 6
_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_2m6y 1
2 1 . . . parsed_2m6y 1
3 1 . . . parsed_2m6y 1
4 1 . . . parsed_2m6y 1
5 1 . . . parsed_2m6y 1
6 1 . . . parsed_2m6y 1
7 1 . . . parsed_2m6y 1
8 1 . . . parsed_2m6y 1
9 1 . . . parsed_2m6y 1
10 1 . . . parsed_2m6y 1
11 1 . . . parsed_2m6y 1
12 1 . . . parsed_2m6y 1
13 1 . . . parsed_2m6y 1
14 1 . . . parsed_2m6y 1
15 1 . . . parsed_2m6y 1
16 1 . . . parsed_2m6y 1
17 1 . . . parsed_2m6y 1
18 1 . . . parsed_2m6y 1
19 1 . . . parsed_2m6y 1
20 1 . . . parsed_2m6y 1
21 1 . . . parsed_2m6y 1
22 1 . . . parsed_2m6y 1
23 1 . . . parsed_2m6y 1
24 1 . . . parsed_2m6y 1
25 1 . . . parsed_2m6y 1
26 1 . . . parsed_2m6y 1
27 1 . . . parsed_2m6y 1
28 1 . . . parsed_2m6y 1
29 1 . . . parsed_2m6y 1
30 1 . . . parsed_2m6y 1
31 1 . . . parsed_2m6y 1
32 1 . . . parsed_2m6y 1
33 1 . . . parsed_2m6y 1
34 1 . . . parsed_2m6y 1
35 1 . . . parsed_2m6y 1
36 1 . . . parsed_2m6y 1
37 1 . . . parsed_2m6y 1
38 1 . . . parsed_2m6y 1
39 1 . . . parsed_2m6y 1
40 1 . . . parsed_2m6y 1
41 1 . . . parsed_2m6y 1
42 1 . . . parsed_2m6y 1
43 1 . . . parsed_2m6y 1
44 1 . . . parsed_2m6y 1
45 1 . . . parsed_2m6y 1
46 1 . . . parsed_2m6y 1
47 1 . . . parsed_2m6y 1
48 1 . . . parsed_2m6y 1
49 1 . . . parsed_2m6y 1
50 1 . . . parsed_2m6y 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 . . . . . . . . . 33 . HN parsed_2m6y 1
1 1 2 . . . . . . . . . 29 . O parsed_2m6y 1
2 1 1 . . . . . . . . . 33 . N parsed_2m6y 1
2 1 2 . . . . . . . . . 29 . O parsed_2m6y 1
3 1 1 . . . . . . . . . 34 . HN parsed_2m6y 1
3 1 2 . . . . . . . . . 30 . O parsed_2m6y 1
4 1 1 . . . . . . . . . 34 . N parsed_2m6y 1
4 1 2 . . . . . . . . . 30 . O parsed_2m6y 1
5 1 1 . . . . . . . . . 35 . HN parsed_2m6y 1
5 1 2 . . . . . . . . . 31 . O parsed_2m6y 1
6 1 1 . . . . . . . . . 35 . N parsed_2m6y 1
6 1 2 . . . . . . . . . 31 . O parsed_2m6y 1
7 1 1 . . . . . . . . . 36 . HN parsed_2m6y 1
7 1 2 . . . . . . . . . 32 . O parsed_2m6y 1
8 1 1 . . . . . . . . . 36 . N parsed_2m6y 1
8 1 2 . . . . . . . . . 32 . O parsed_2m6y 1
9 1 1 . . . . . . . . . 37 . HN parsed_2m6y 1
9 1 2 . . . . . . . . . 33 . O parsed_2m6y 1
10 1 1 . . . . . . . . . 37 . N parsed_2m6y 1
10 1 2 . . . . . . . . . 33 . O parsed_2m6y 1
11 1 1 . . . . . . . . . 38 . HN parsed_2m6y 1
11 1 2 . . . . . . . . . 34 . O parsed_2m6y 1
12 1 1 . . . . . . . . . 38 . N parsed_2m6y 1
12 1 2 . . . . . . . . . 34 . O parsed_2m6y 1
13 1 1 . . . . . . . . . 39 . HN parsed_2m6y 1
13 1 2 . . . . . . . . . 35 . O parsed_2m6y 1
14 1 1 . . . . . . . . . 39 . N parsed_2m6y 1
14 1 2 . . . . . . . . . 35 . O parsed_2m6y 1
15 1 1 . . . . . . . . . 40 . HN parsed_2m6y 1
15 1 2 . . . . . . . . . 36 . O parsed_2m6y 1
16 1 1 . . . . . . . . . 40 . N parsed_2m6y 1
16 1 2 . . . . . . . . . 36 . O parsed_2m6y 1
17 1 1 . . . . . . . . . 41 . HN parsed_2m6y 1
17 1 2 . . . . . . . . . 37 . O parsed_2m6y 1
18 1 1 . . . . . . . . . 41 . N parsed_2m6y 1
18 1 2 . . . . . . . . . 37 . O parsed_2m6y 1
19 1 1 . . . . . . . . . 42 . HN parsed_2m6y 1
19 1 2 . . . . . . . . . 38 . O parsed_2m6y 1
20 1 1 . . . . . . . . . 42 . N parsed_2m6y 1
20 1 2 . . . . . . . . . 38 . O parsed_2m6y 1
21 1 1 . . . . . . . . . 43 . HN parsed_2m6y 1
21 1 2 . . . . . . . . . 39 . O parsed_2m6y 1
22 1 1 . . . . . . . . . 43 . N parsed_2m6y 1
22 1 2 . . . . . . . . . 39 . O parsed_2m6y 1
23 1 1 . . . . . . . . . 56 . HN parsed_2m6y 1
23 1 2 . . . . . . . . . 52 . O parsed_2m6y 1
24 1 1 . . . . . . . . . 56 . N parsed_2m6y 1
24 1 2 . . . . . . . . . 52 . O parsed_2m6y 1
25 1 1 . . . . . . . . . 58 . HN parsed_2m6y 1
25 1 2 . . . . . . . . . 54 . O parsed_2m6y 1
26 1 1 . . . . . . . . . 58 . N parsed_2m6y 1
26 1 2 . . . . . . . . . 54 . O parsed_2m6y 1
27 1 1 . . . . . . . . . 59 . HN parsed_2m6y 1
27 1 2 . . . . . . . . . 55 . O parsed_2m6y 1
28 1 1 . . . . . . . . . 59 . N parsed_2m6y 1
28 1 2 . . . . . . . . . 55 . O parsed_2m6y 1
29 1 1 . . . . . . . . . 60 . HN parsed_2m6y 1
29 1 2 . . . . . . . . . 56 . O parsed_2m6y 1
30 1 1 . . . . . . . . . 60 . N parsed_2m6y 1
30 1 2 . . . . . . . . . 56 . O parsed_2m6y 1
31 1 1 . . . . . . . . . 61 . HN parsed_2m6y 1
31 1 2 . . . . . . . . . 57 . O parsed_2m6y 1
32 1 1 . . . . . . . . . 61 . N parsed_2m6y 1
32 1 2 . . . . . . . . . 57 . O parsed_2m6y 1
33 1 1 . . . . . . . . . 62 . HN parsed_2m6y 1
33 1 2 . . . . . . . . . 58 . O parsed_2m6y 1
34 1 1 . . . . . . . . . 62 . N parsed_2m6y 1
34 1 2 . . . . . . . . . 58 . O parsed_2m6y 1
35 1 1 . . . . . . . . . 63 . HN parsed_2m6y 1
35 1 2 . . . . . . . . . 59 . O parsed_2m6y 1
36 1 1 . . . . . . . . . 63 . N parsed_2m6y 1
36 1 2 . . . . . . . . . 59 . O parsed_2m6y 1
37 1 1 . . . . . . . . . 64 . HN parsed_2m6y 1
37 1 2 . . . . . . . . . 60 . O parsed_2m6y 1
38 1 1 . . . . . . . . . 64 . N parsed_2m6y 1
38 1 2 . . . . . . . . . 60 . O parsed_2m6y 1
39 1 1 . . . . . . . . . 65 . HN parsed_2m6y 1
39 1 2 . . . . . . . . . 61 . O parsed_2m6y 1
40 1 1 . . . . . . . . . 65 . N parsed_2m6y 1
40 1 2 . . . . . . . . . 61 . O parsed_2m6y 1
41 1 1 . . . . . . . . . 72 . HN parsed_2m6y 1
41 1 2 . . . . . . . . . 68 . O parsed_2m6y 1
42 1 1 . . . . . . . . . 72 . N parsed_2m6y 1
42 1 2 . . . . . . . . . 68 . O parsed_2m6y 1
43 1 1 . . . . . . . . . 73 . HN parsed_2m6y 1
43 1 2 . . . . . . . . . 69 . O parsed_2m6y 1
44 1 1 . . . . . . . . . 73 . N parsed_2m6y 1
44 1 2 . . . . . . . . . 69 . O parsed_2m6y 1
45 1 1 . . . . . . . . . 74 . HN parsed_2m6y 1
45 1 2 . . . . . . . . . 70 . O parsed_2m6y 1
46 1 1 . . . . . . . . . 74 . N parsed_2m6y 1
46 1 2 . . . . . . . . . 70 . O parsed_2m6y 1
47 1 1 . . . . . . . . . 75 . HN parsed_2m6y 1
47 1 2 . . . . . . . . . 71 . O parsed_2m6y 1
48 1 1 . . . . . . . . . 75 . N parsed_2m6y 1
48 1 2 . . . . . . . . . 71 . O parsed_2m6y 1
49 1 1 . . . . . . . . . 76 . HN parsed_2m6y 1
49 1 2 . . . . . . . . . 72 . O parsed_2m6y 1
50 1 1 . . . . . . . . . 76 . N parsed_2m6y 1
50 1 2 . . . . . . . . . 72 . O parsed_2m6y 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 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
2 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
3 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
4 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
5 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
6 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
7 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
8 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
9 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
10 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
11 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
12 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
13 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
14 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
15 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
16 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
17 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
18 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
19 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
20 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
21 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
22 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
23 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
24 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
25 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
26 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
27 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
28 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
29 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
30 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
31 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
32 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
33 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
34 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
35 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
36 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
37 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
38 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
39 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
40 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
41 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
42 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
43 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
44 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
45 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
46 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
47 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
48 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 1
49 1 . . . . . 1.800 1.500 2.300 parsed_2m6y 1
50 1 . . . . . 2.800 2.400 3.300 parsed_2m6y 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 "assign (resid 33 and name N) (resid 33 and name HN) (resid 29 and name O)" 1 1 1 73 parsed_2m6y 1
2 "assign (resid 34 and name N) (resid 34 and name HN) (resid 30 and name O)" 2 1 2 73 parsed_2m6y 1
3 "assign (resid 35 and name N) (resid 35 and name HN) (resid 31 and name O)" 3 1 3 73 parsed_2m6y 1
4 "assign (resid 36 and name N) (resid 36 and name HN) (resid 32 and name O)" 4 1 4 73 parsed_2m6y 1
5 "assign (resid 37 and name N) (resid 37 and name HN) (resid 33 and name O)" 5 1 5 73 parsed_2m6y 1
6 "assign (resid 38 and name N) (resid 38 and name HN) (resid 34 and name O)" 6 1 6 73 parsed_2m6y 1
7 "assign (resid 39 and name N) (resid 39 and name HN) (resid 35 and name O)" 7 1 7 73 parsed_2m6y 1
8 "assign (resid 40 and name N) (resid 40 and name HN) (resid 36 and name O)" 8 1 8 73 parsed_2m6y 1
9 "assign (resid 41 and name N) (resid 41 and name HN) (resid 37 and name O)" 9 1 9 73 parsed_2m6y 1
10 "assign (resid 42 and name N) (resid 42 and name HN) (resid 38 and name O)" 10 1 10 73 parsed_2m6y 1
11 "assign (resid 43 and name N) (resid 43 and name HN) (resid 39 and name O)" 11 1 11 73 parsed_2m6y 1
12 "assign (resid 56 and name N) (resid 56 and name HN) (resid 52 and name O)" 12 1 12 73 parsed_2m6y 1
13 "assign (resid 58 and name N) (resid 58 and name HN) (resid 54 and name O)" 13 1 13 73 parsed_2m6y 1
14 "assign (resid 59 and name N) (resid 59 and name HN) (resid 55 and name O)" 14 1 14 73 parsed_2m6y 1
15 "assign (resid 60 and name N) (resid 60 and name HN) (resid 56 and name O)" 15 1 15 73 parsed_2m6y 1
16 "assign (resid 61 and name N) (resid 61 and name HN) (resid 57 and name O)" 16 1 16 73 parsed_2m6y 1
17 "assign (resid 62 and name N) (resid 62 and name HN) (resid 58 and name O)" 17 1 17 73 parsed_2m6y 1
18 "assign (resid 63 and name N) (resid 63 and name HN) (resid 59 and name O)" 18 1 18 73 parsed_2m6y 1
19 "assign (resid 64 and name N) (resid 64 and name HN) (resid 60 and name O)" 19 1 19 73 parsed_2m6y 1
20 "assign (resid 65 and name N) (resid 65 and name HN) (resid 61 and name O)" 20 1 20 73 parsed_2m6y 1
21 "assign (resid 72 and name N) (resid 72 and name HN) (resid 68 and name O)" 21 1 21 73 parsed_2m6y 1
22 "assign (resid 73 and name N) (resid 73 and name HN) (resid 69 and name O)" 22 1 22 73 parsed_2m6y 1
23 "assign (resid 74 and name N) (resid 74 and name HN) (resid 70 and name O)" 23 1 23 73 parsed_2m6y 1
24 "assign (resid 75 and name N) (resid 75 and name HN) (resid 71 and name O)" 24 1 24 73 parsed_2m6y 1
25 "assign (resid 76 and name N) (resid 76 and name HN) (resid 72 and name O)" 25 1 25 73 parsed_2m6y 1
stop_
save_
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