NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
36369 |
1nev   |
cing | 2-parsed | STAR | distance | hydrogen bond | simple | 52 |
data_1nev_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1nev
_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_1nev 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1nev
_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 1nev "Master copy" parsed_1nev
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1nev
_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 1nev.mr . . "MR format" 1 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 2 distance NOE simple 422 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 52 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 7 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 8 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 9 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 10 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 11 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . XPLOR/CNS 12 planarity "Not applicable" "Not applicable" 0 parsed_1nev 1
1 1nev.mr . . "MR format" 13 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1nev 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1nev
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 3
_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_1nev 1
2 1 . . . parsed_1nev 1
3 1 . . . parsed_1nev 1
4 1 . . . parsed_1nev 1
5 1 . . . parsed_1nev 1
6 1 . . . parsed_1nev 1
7 1 . . . parsed_1nev 1
8 1 . . . parsed_1nev 1
9 1 . . . parsed_1nev 1
10 1 . . . parsed_1nev 1
11 1 . . . parsed_1nev 1
12 1 . . . parsed_1nev 1
13 1 . . . parsed_1nev 1
14 1 . . . parsed_1nev 1
15 1 . . . parsed_1nev 1
16 1 . . . parsed_1nev 1
17 1 . . . parsed_1nev 1
18 1 . . . parsed_1nev 1
19 1 . . . parsed_1nev 1
20 1 . . . parsed_1nev 1
21 1 . . . parsed_1nev 1
22 1 . . . parsed_1nev 1
23 1 . . . parsed_1nev 1
24 1 . . . parsed_1nev 1
25 1 . . . parsed_1nev 1
26 1 . . . parsed_1nev 1
27 1 . . . parsed_1nev 1
28 1 . . . parsed_1nev 1
29 1 . . . parsed_1nev 1
30 1 . . . parsed_1nev 1
31 1 . . . parsed_1nev 1
32 1 . . . parsed_1nev 1
33 1 . . . parsed_1nev 1
34 1 . . . parsed_1nev 1
35 1 . . . parsed_1nev 1
36 1 . . . parsed_1nev 1
37 1 . . . parsed_1nev 1
38 1 . . . parsed_1nev 1
39 1 . . . parsed_1nev 1
40 1 . . . parsed_1nev 1
41 1 . . . parsed_1nev 1
42 1 . . . parsed_1nev 1
43 1 . . . parsed_1nev 1
44 1 . . . parsed_1nev 1
45 1 . . . parsed_1nev 1
46 1 . . . parsed_1nev 1
47 1 . . . parsed_1nev 1
48 1 . . . parsed_1nev 1
49 1 . . . parsed_1nev 1
50 1 . . . parsed_1nev 1
51 1 . . . parsed_1nev 1
52 1 . . . parsed_1nev 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 . . . . . . . . A 1 . H1 parsed_1nev 1
1 1 2 . . . . . . . . B 20 . N3 parsed_1nev 1
2 1 1 . . . . . . . . A 1 . N1 parsed_1nev 1
2 1 2 . . . . . . . . B 20 . N3 parsed_1nev 1
3 1 1 . . . . . . . . A 1 . H22 parsed_1nev 1
3 1 2 . . . . . . . . B 20 . O2 parsed_1nev 1
4 1 1 . . . . . . . . A 1 . N2 parsed_1nev 1
4 1 2 . . . . . . . . B 20 . O2 parsed_1nev 1
5 1 1 . . . . . . . . A 1 . O6 parsed_1nev 1
5 1 2 . . . . . . . . B 20 . H42 parsed_1nev 1
6 1 1 . . . . . . . . A 1 . O6 parsed_1nev 1
6 1 2 . . . . . . . . B 20 . N4 parsed_1nev 1
7 1 1 . . . . . . . . A 2 . H1 parsed_1nev 1
7 1 2 . . . . . . . . B 19 . N3 parsed_1nev 1
8 1 1 . . . . . . . . A 2 . N1 parsed_1nev 1
8 1 2 . . . . . . . . B 19 . N3 parsed_1nev 1
9 1 1 . . . . . . . . A 2 . H22 parsed_1nev 1
9 1 2 . . . . . . . . B 19 . O2 parsed_1nev 1
10 1 1 . . . . . . . . A 2 . N2 parsed_1nev 1
10 1 2 . . . . . . . . B 19 . O2 parsed_1nev 1
11 1 1 . . . . . . . . A 2 . O6 parsed_1nev 1
11 1 2 . . . . . . . . B 19 . H42 parsed_1nev 1
12 1 1 . . . . . . . . A 2 . O6 parsed_1nev 1
12 1 2 . . . . . . . . B 19 . N4 parsed_1nev 1
13 1 1 . . . . . . . . A 3 . N3 parsed_1nev 1
13 1 2 . . . . . . . . B 18 . H1 parsed_1nev 1
14 1 1 . . . . . . . . A 3 . N3 parsed_1nev 1
14 1 2 . . . . . . . . B 18 . N1 parsed_1nev 1
15 1 1 . . . . . . . . A 3 . O2 parsed_1nev 1
15 1 2 . . . . . . . . B 18 . H22 parsed_1nev 1
16 1 1 . . . . . . . . A 3 . O2 parsed_1nev 1
16 1 2 . . . . . . . . B 18 . N2 parsed_1nev 1
17 1 1 . . . . . . . . A 3 . H42 parsed_1nev 1
17 1 2 . . . . . . . . B 18 . O6 parsed_1nev 1
18 1 1 . . . . . . . . A 3 . N4 parsed_1nev 1
18 1 2 . . . . . . . . B 18 . O6 parsed_1nev 1
19 1 1 . . . . . . . . A 4 . N1 parsed_1nev 1
19 1 2 . . . . . . . . B 17 . H3 parsed_1nev 1
20 1 1 . . . . . . . . A 4 . N1 parsed_1nev 1
20 1 2 . . . . . . . . B 17 . N3 parsed_1nev 1
21 1 1 . . . . . . . . A 4 . N6 parsed_1nev 1
21 1 2 . . . . . . . . B 17 . O4 parsed_1nev 1
22 1 1 . . . . . . . . A 4 . H62 parsed_1nev 1
22 1 2 . . . . . . . . B 17 . O4 parsed_1nev 1
23 1 1 . . . . . . . . A 5 . N1 parsed_1nev 1
23 1 2 . . . . . . . . B 16 . H3 parsed_1nev 1
24 1 1 . . . . . . . . A 5 . N1 parsed_1nev 1
24 1 2 . . . . . . . . B 16 . N3 parsed_1nev 1
25 1 1 . . . . . . . . A 5 . N6 parsed_1nev 1
25 1 2 . . . . . . . . B 16 . O4 parsed_1nev 1
26 1 1 . . . . . . . . A 5 . H62 parsed_1nev 1
26 1 2 . . . . . . . . B 16 . O4 parsed_1nev 1
27 1 1 . . . . . . . . A 6 . N1 parsed_1nev 1
27 1 2 . . . . . . . . B 15 . H3 parsed_1nev 1
28 1 1 . . . . . . . . A 6 . N1 parsed_1nev 1
28 1 2 . . . . . . . . B 15 . N3 parsed_1nev 1
29 1 1 . . . . . . . . A 6 . N6 parsed_1nev 1
29 1 2 . . . . . . . . B 15 . O4 parsed_1nev 1
30 1 1 . . . . . . . . A 6 . H62 parsed_1nev 1
30 1 2 . . . . . . . . B 15 . O4 parsed_1nev 1
31 1 1 . . . . . . . . A 7 . N1 parsed_1nev 1
31 1 2 . . . . . . . . B 14 . H3 parsed_1nev 1
32 1 1 . . . . . . . . A 7 . N1 parsed_1nev 1
32 1 2 . . . . . . . . B 14 . N3 parsed_1nev 1
33 1 1 . . . . . . . . A 7 . N6 parsed_1nev 1
33 1 2 . . . . . . . . B 14 . O4 parsed_1nev 1
34 1 1 . . . . . . . . A 7 . H62 parsed_1nev 1
34 1 2 . . . . . . . . B 14 . O4 parsed_1nev 1
35 1 1 . . . . . . . . A 8 . N3 parsed_1nev 1
35 1 2 . . . . . . . . B 13 . H1 parsed_1nev 1
36 1 1 . . . . . . . . A 8 . N3 parsed_1nev 1
36 1 2 . . . . . . . . B 13 . N1 parsed_1nev 1
37 1 1 . . . . . . . . A 8 . O2 parsed_1nev 1
37 1 2 . . . . . . . . B 13 . H22 parsed_1nev 1
38 1 1 . . . . . . . . A 8 . O2 parsed_1nev 1
38 1 2 . . . . . . . . B 13 . N2 parsed_1nev 1
39 1 1 . . . . . . . . A 8 . H42 parsed_1nev 1
39 1 2 . . . . . . . . B 13 . O6 parsed_1nev 1
40 1 1 . . . . . . . . A 8 . N4 parsed_1nev 1
40 1 2 . . . . . . . . B 13 . O6 parsed_1nev 1
41 1 1 . . . . . . . . A 9 . H1 parsed_1nev 1
41 1 2 . . . . . . . . B 12 . N3 parsed_1nev 1
42 1 1 . . . . . . . . A 9 . N1 parsed_1nev 1
42 1 2 . . . . . . . . B 12 . N3 parsed_1nev 1
43 1 1 . . . . . . . . A 9 . H22 parsed_1nev 1
43 1 2 . . . . . . . . B 12 . O2 parsed_1nev 1
44 1 1 . . . . . . . . A 9 . N2 parsed_1nev 1
44 1 2 . . . . . . . . B 12 . O2 parsed_1nev 1
45 1 1 . . . . . . . . A 9 . O6 parsed_1nev 1
45 1 2 . . . . . . . . B 12 . H42 parsed_1nev 1
46 1 1 . . . . . . . . A 9 . O6 parsed_1nev 1
46 1 2 . . . . . . . . B 12 . N4 parsed_1nev 1
47 1 1 . . . . . . . . A 10 . H1 parsed_1nev 1
47 1 2 . . . . . . . . B 11 . N3 parsed_1nev 1
48 1 1 . . . . . . . . A 10 . N1 parsed_1nev 1
48 1 2 . . . . . . . . B 11 . N3 parsed_1nev 1
49 1 1 . . . . . . . . A 10 . H22 parsed_1nev 1
49 1 2 . . . . . . . . B 11 . O2 parsed_1nev 1
50 1 1 . . . . . . . . A 10 . N2 parsed_1nev 1
50 1 2 . . . . . . . . B 11 . O2 parsed_1nev 1
51 1 1 . . . . . . . . A 10 . O6 parsed_1nev 1
51 1 2 . . . . . . . . B 11 . H42 parsed_1nev 1
52 1 1 . . . . . . . . A 10 . O6 parsed_1nev 1
52 1 2 . . . . . . . . B 11 . N4 parsed_1nev 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 . . . . . 1.85 1.75 1.95 parsed_1nev 1
2 1 . . . . . 2.91 2.71 3.41 parsed_1nev 1
3 1 . . . . . 1.98 1.78 2.48 parsed_1nev 1
4 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
5 1 . . . . . 1.67 1.47 2.17 parsed_1nev 1
6 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
7 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
8 1 . . . . . 2.91 2.71 3.21 parsed_1nev 1
9 1 . . . . . 1.98 1.78 2.28 parsed_1nev 1
10 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
11 1 . . . . . 1.67 1.47 1.97 parsed_1nev 1
12 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
13 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
14 1 . . . . . 2.91 2.71 3.21 parsed_1nev 1
15 1 . . . . . 1.98 1.78 2.28 parsed_1nev 1
16 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
17 1 . . . . . 1.67 1.47 1.97 parsed_1nev 1
18 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
19 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
20 1 . . . . . 2.95 2.75 3.25 parsed_1nev 1
21 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
22 1 . . . . . 1.78 1.58 2.08 parsed_1nev 1
23 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
24 1 . . . . . 2.95 2.75 3.25 parsed_1nev 1
25 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
26 1 . . . . . 1.78 1.58 2.08 parsed_1nev 1
27 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
28 1 . . . . . 2.95 2.75 3.25 parsed_1nev 1
29 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
30 1 . . . . . 1.78 1.58 2.08 parsed_1nev 1
31 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
32 1 . . . . . 2.95 2.75 3.25 parsed_1nev 1
33 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
34 1 . . . . . 1.78 1.58 2.08 parsed_1nev 1
35 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
36 1 . . . . . 2.91 2.71 3.21 parsed_1nev 1
37 1 . . . . . 1.98 1.78 2.28 parsed_1nev 1
38 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
39 1 . . . . . 1.67 1.47 1.97 parsed_1nev 1
40 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
41 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
42 1 . . . . . 2.91 2.71 3.21 parsed_1nev 1
43 1 . . . . . 1.98 1.78 2.28 parsed_1nev 1
44 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
45 1 . . . . . 1.67 1.47 1.97 parsed_1nev 1
46 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
47 1 . . . . . 1.85 1.75 1.95 parsed_1nev 1
48 1 . . . . . 2.91 2.71 3.31 parsed_1nev 1
49 1 . . . . . 1.98 1.78 2.38 parsed_1nev 1
50 1 . . . . . 2.90 2.65 3.15 parsed_1nev 1
51 1 . . . . . 1.67 1.47 2.07 parsed_1nev 1
52 1 . . . . . 2.90 2.65 3.15 parsed_1nev 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
;
base pairing constraint file
created by noe_hbond_make.pl
Distances followed by exclamation mark are from bax's d12
G1-C20 Watson-Crick (B-form DNA)
;
1 1 5 35 parsed_1nev 1
2 "G2-C19 Watson-Crick (B-form DNA)" 12 1 12 35 parsed_1nev 1
3 "C3-G18 Watson-Crick (B-form DNA)" 19 1 19 35 parsed_1nev 1
4 "A4-T17 Watson-Crick (B-form DNA)" 26 1 26 35 parsed_1nev 1
5 "A5-T16 Watson-Crick (B-form DNA)" 31 1 31 35 parsed_1nev 1
6 "A6-T15 Watson-Crick (B-form DNA)" 36 1 36 35 parsed_1nev 1
7 "A7-T14 Watson-Crick (B-form DNA)" 41 1 41 35 parsed_1nev 1
8 "C8-G13 Watson-Crick (B-form DNA)" 46 1 46 35 parsed_1nev 1
9 "G9-C12 Watson-Crick (B-form DNA)" 53 1 53 35 parsed_1nev 1
10 "G10-C11 Watson-Crick (B-form DNA)" 60 1 60 36 parsed_1nev 1
stop_
save_
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