NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
30721 |
1d6d   |
cing | 2-parsed | STAR | distance | NOE | simple | 42 |
data_1d6d_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1d6d
_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_1d6d 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1d6d
_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 1d6d "Master copy" parsed_1d6d
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1d6d
_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 1d6d.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1d6d 1
1 1d6d.mr . . XPLOR/CNS 2 distance NOE simple 264 parsed_1d6d 1
1 1d6d.mr . . n/a 3 comment "Not applicable" "Not applicable" 0 parsed_1d6d 1
1 1d6d.mr . . XPLOR/CNS 4 distance NOE simple 37 parsed_1d6d 1
1 1d6d.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_1d6d 1
1 1d6d.mr . . XPLOR/CNS 6 distance NOE simple 42 parsed_1d6d 1
1 1d6d.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1d6d 1
stop_
save_
save_CNS/XPLOR_distance_constraints_6
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1d6d
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_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_1d6d 1
2 1 . . . parsed_1d6d 1
3 1 . . . parsed_1d6d 1
4 1 . . . parsed_1d6d 1
5 1 . . . parsed_1d6d 1
6 1 . . . parsed_1d6d 1
7 1 . . . parsed_1d6d 1
8 1 . . . parsed_1d6d 1
9 1 . . . parsed_1d6d 1
10 1 . . . parsed_1d6d 1
11 1 . . . parsed_1d6d 1
12 1 . . . parsed_1d6d 1
13 1 . . . parsed_1d6d 1
14 1 . . . parsed_1d6d 1
15 1 . . . parsed_1d6d 1
16 1 . . . parsed_1d6d 1
17 1 . . . parsed_1d6d 1
18 1 . . . parsed_1d6d 1
19 1 . . . parsed_1d6d 1
20 1 . . . parsed_1d6d 1
21 1 . . . parsed_1d6d 1
22 1 . . . parsed_1d6d 1
23 1 . . . parsed_1d6d 1
24 1 . . . parsed_1d6d 1
25 1 . . . parsed_1d6d 1
26 1 . . . parsed_1d6d 1
27 1 . . . parsed_1d6d 1
28 1 . . . parsed_1d6d 1
29 1 . . . parsed_1d6d 1
30 1 . . . parsed_1d6d 1
31 1 . . . parsed_1d6d 1
32 1 . . . parsed_1d6d 1
33 1 . . . parsed_1d6d 1
34 1 . . . parsed_1d6d 1
35 1 . . . parsed_1d6d 1
36 1 . . . parsed_1d6d 1
37 1 . . . parsed_1d6d 1
38 1 . . . parsed_1d6d 1
39 1 . . . parsed_1d6d 1
40 1 . . . parsed_1d6d 1
41 1 . . . parsed_1d6d 1
42 1 . . . parsed_1d6d 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 . . . . . . . . . 5 . H3 parsed_1d6d 1
1 1 2 . . . . . . . . . 9 . H8 parsed_1d6d 1
2 1 1 . . . . . . . . . 5 . H3 parsed_1d6d 1
2 1 2 . . . . . . . . . 4 . H1 parsed_1d6d 1
3 1 1 . . . . . . . . . 5 . H3 parsed_1d6d 1
3 1 2 . . . . . . . . . 9 . H1' parsed_1d6d 1
4 1 1 . . . . . . . . . 5 . H3 parsed_1d6d 1
4 1 2 . . . . . . . . . 7 . H6 parsed_1d6d 1
5 1 1 . . . . . . . . . 5 . H3 parsed_1d6d 1
5 1 2 . . . . . . . . . 5 . H1' parsed_1d6d 1
6 1 1 . . . . . . . . . 5 . H3 parsed_1d6d 1
6 1 2 . . . . . . . . . 5 . H5# parsed_1d6d 1
7 1 1 . . . . . . . . . 5 . H3 parsed_1d6d 1
7 1 2 . . . . . . . . . 7 . H5# parsed_1d6d 1
8 1 1 . . . . . . . . . 5 . H3 parsed_1d6d 1
8 1 2 . . . . . . . . . 12 . H8 parsed_1d6d 1
9 1 1 . . . . . . . . . 7 . H3 parsed_1d6d 1
9 1 2 . . . . . . . . . 2 . H8 parsed_1d6d 1
10 1 1 . . . . . . . . . 7 . H3 parsed_1d6d 1
10 1 2 . . . . . . . . . 2 . H61 parsed_1d6d 1
11 1 1 . . . . . . . . . 7 . H3 parsed_1d6d 1
11 1 2 . . . . . . . . . 2 . H62 parsed_1d6d 1
12 1 1 . . . . . . . . . 7 . H3 parsed_1d6d 1
12 1 2 . . . . . . . . . 5 . H5# parsed_1d6d 1
13 1 1 . . . . . . . . . 7 . H3 parsed_1d6d 1
13 1 2 . . . . . . . . . 9 . H8 parsed_1d6d 1
14 1 1 . . . . . . . . . 7 . H3 parsed_1d6d 1
14 1 2 . . . . . . . . . 9 . H1' parsed_1d6d 1
15 1 1 . . . . . . . . . 7 . H3 parsed_1d6d 1
15 1 2 . . . . . . . . . 7 . H5# parsed_1d6d 1
16 1 1 . . . . . . . . . 12 . H1 parsed_1d6d 1
16 1 2 . . . . . . . . . 10 . H8 parsed_1d6d 1
17 1 1 . . . . . . . . . 12 . H1 parsed_1d6d 1
17 1 2 . . . . . . . . . 9 . H1' parsed_1d6d 1
18 1 1 . . . . . . . . . 12 . H1 parsed_1d6d 1
18 1 2 . . . . . . . . . 11 . H8 parsed_1d6d 1
19 1 1 . . . . . . . . . 12 . H1 parsed_1d6d 1
19 1 2 . . . . . . . . . 9 . H8 parsed_1d6d 1
20 1 1 . . . . . . . . . 11 . H1 parsed_1d6d 1
20 1 2 . . . . . . . . . 10 . H1' parsed_1d6d 1
21 1 1 . . . . . . . . . 11 . H1 parsed_1d6d 1
21 1 2 . . . . . . . . . 11 . H2# parsed_1d6d 1
22 1 1 . . . . . . . . . 11 . H1 parsed_1d6d 1
22 1 2 . . . . . . . . . 10 . H8 parsed_1d6d 1
23 1 1 . . . . . . . . . 11 . H1 parsed_1d6d 1
23 1 2 . . . . . . . . . 3 . H1 parsed_1d6d 1
24 1 1 . . . . . . . . . 11 . H1 parsed_1d6d 1
24 1 2 . . . . . . . . . 3 . H8 parsed_1d6d 1
25 1 1 . . . . . . . . . 11 . H1 parsed_1d6d 1
25 1 2 . . . . . . . . . 9 . H1' parsed_1d6d 1
26 1 1 . . . . . . . . . 11 . H1 parsed_1d6d 1
26 1 2 . . . . . . . . . 10 . H2'* parsed_1d6d 1
27 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
27 1 2 . . . . . . . . . 9 . H8 parsed_1d6d 1
28 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
28 1 2 . . . . . . . . . 11 . H1 parsed_1d6d 1
29 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
29 1 2 . . . . . . . . . 12 . H8 parsed_1d6d 1
30 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
30 1 2 . . . . . . . . . 9 . H1' parsed_1d6d 1
31 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
31 1 2 . . . . . . . . . 11 . H2# parsed_1d6d 1
32 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
32 1 2 . . . . . . . . . 10 . H8 parsed_1d6d 1
33 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
33 1 2 . . . . . . . . . 10 . H1' parsed_1d6d 1
34 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
34 1 2 . . . . . . . . . 5 . H5# parsed_1d6d 1
35 1 1 . . . . . . . . . 4 . H1 parsed_1d6d 1
35 1 2 . . . . . . . . . 3 . H1 parsed_1d6d 1
36 1 1 . . . . . . . . . 3 . H1 parsed_1d6d 1
36 1 2 . . . . . . . . . 4 . H8 parsed_1d6d 1
37 1 1 . . . . . . . . . 3 . H1 parsed_1d6d 1
37 1 2 . . . . . . . . . 5 . H5# parsed_1d6d 1
38 1 1 . . . . . . . . . 3 . H1 parsed_1d6d 1
38 1 2 . . . . . . . . . 9 . H8 parsed_1d6d 1
39 1 1 . . . . . . . . . 3 . H1 parsed_1d6d 1
39 1 2 . . . . . . . . . 9 . H1' parsed_1d6d 1
40 1 1 . . . . . . . . . 3 . H1 parsed_1d6d 1
40 1 2 . . . . . . . . . 3 . H1' parsed_1d6d 1
41 1 1 . . . . . . . . . 3 . H1 parsed_1d6d 1
41 1 2 . . . . . . . . . 3 . H2*' parsed_1d6d 1
42 1 1 . . . . . . . . . 3 . H1 parsed_1d6d 1
42 1 2 . . . . . . . . . 10 . H1' parsed_1d6d 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 . . . . . 2.5 1.4 3.6 parsed_1d6d 1
2 1 . . . . . 3.5 2.5 4.5 parsed_1d6d 1
3 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
4 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
5 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
6 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
7 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
8 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
9 1 . . . . . 2.5 1.5 3.5 parsed_1d6d 1
10 1 . . . . . 2.5 1.5 3.5 parsed_1d6d 1
11 1 . . . . . 3.5 1.5 5.5 parsed_1d6d 1
12 1 . . . . . 3.5 1.5 5.5 parsed_1d6d 1
13 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
14 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
15 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
16 1 . . . . . 3.5 2.5 4.5 parsed_1d6d 1
17 1 . . . . . 3.5 2.5 4.5 parsed_1d6d 1
18 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
19 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
20 1 . . . . . 2.5 1.0 4.0 parsed_1d6d 1
21 1 . . . . . 2.5 1.5 3.5 parsed_1d6d 1
22 1 . . . . . 3.5 2.5 4.5 parsed_1d6d 1
23 1 . . . . . 3.5 2.5 4.5 parsed_1d6d 1
24 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
25 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
26 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
27 1 . . . . . 2.5 1.0 4.0 parsed_1d6d 1
28 1 . . . . . 2.5 1.0 4.0 parsed_1d6d 1
29 1 . . . . . 3.5 1.5 5.5 parsed_1d6d 1
30 1 . . . . . 3.5 1.5 5.5 parsed_1d6d 1
31 1 . . . . . 3.5 2.5 4.5 parsed_1d6d 1
32 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
33 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
34 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
35 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
36 1 . . . . . 3.5 1.5 5.5 parsed_1d6d 1
37 1 . . . . . 3.5 1.5 5.5 parsed_1d6d 1
38 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
39 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
40 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 1
41 1 . . . . . 4.5 3.5 5.5 parsed_1d6d 1
42 1 . . . . . 4.5 2.5 6.5 parsed_1d6d 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 medium 2 1 2 8 parsed_1d6d 1
2 weak 4 1 4 6 parsed_1d6d 1
3
;
imino proton of the T7
strong
;
12 1 14 8 parsed_1d6d 1
4 medium 17 1 17 8 parsed_1d6d 1
5 weak 20 1 20 6 parsed_1d6d 1
6
;
imino proton of G12
medium
;
25 1 27 8 parsed_1d6d 1
7 weak 30 1 30 6 parsed_1d6d 1
8
;
imino proton of G11
strong
;
33 1 34 8 parsed_1d6d 1
9 medium 37 1 37 8 parsed_1d6d 1
10 weak 40 1 40 6 parsed_1d6d 1
11
;
imino proton of G4
strong
;
45 1 47 8 parsed_1d6d 1
12 medium 50 1 50 8 parsed_1d6d 1
13 weak 54 1 54 6 parsed_1d6d 1
14
;
imino proton of G3
medium
;
60 1 62 8 parsed_1d6d 1
15 weak 65 1 65 6 parsed_1d6d 1
stop_
save_
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