Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
515563 | 1lud RC | 5396 | cing | 2-parsed | STAR | distance | hydrogen bond | ambi | 64 |
data_1lud_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1lud
_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_1lud 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1lud
_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 1lud "Master copy" parsed_1lud
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1lud
_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 1lud.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 2 distance NOE simple 2445 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 3 distance NOE ambi 85 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 4 distance "hydrogen bond" simple 132 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 5 distance "hydrogen bond" ambi 64 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 6 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 8 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 9 "coupling constant" "Not applicable" "Not applicable" 0 parsed_1lud 1
1 1lud.mr . . XPLOR/CNS 10 "chemical shift" "Not applicable" "Not applicable" 0 parsed_1lud 1
1 1lud.mr . . "MR format" 11 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1lud 1
stop_
save_
save_CNS/XPLOR_distance_constraints_5
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1lud
_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_1lud 1
2 1 . . . parsed_1lud 1
3 1 . . . parsed_1lud 1
4 1 . . . parsed_1lud 1
5 1 . . . parsed_1lud 1
6 1 . . . parsed_1lud 1
7 1 . . . parsed_1lud 1
8 1 . . . parsed_1lud 1
9 1 . . . parsed_1lud 1
10 1 . . . parsed_1lud 1
11 1 . . . parsed_1lud 1
12 1 . . . parsed_1lud 1
13 1 . . . parsed_1lud 1
14 1 . . . parsed_1lud 1
15 1 . . . parsed_1lud 1
16 1 . . . parsed_1lud 1
17 1 . . . parsed_1lud 1
18 1 . . . parsed_1lud 1
19 1 . . . parsed_1lud 1
20 1 . . . parsed_1lud 1
21 1 . . . parsed_1lud 1
22 1 . . . parsed_1lud 1
23 1 . . . parsed_1lud 1
24 1 . . . parsed_1lud 1
25 1 . . . parsed_1lud 1
26 1 . . . parsed_1lud 1
27 1 . . . parsed_1lud 1
28 1 . . . parsed_1lud 1
29 1 . . . parsed_1lud 1
30 1 . . . parsed_1lud 1
31 1 . . . parsed_1lud 1
32 1 . . . parsed_1lud 1
33 1 . . . parsed_1lud 1
34 1 . . . parsed_1lud 1
35 1 . . . parsed_1lud 1
36 1 . . . parsed_1lud 1
37 1 . . . parsed_1lud 1
38 1 . . . parsed_1lud 1
39 1 . . . parsed_1lud 1
40 1 . . . parsed_1lud 1
41 1 . . . parsed_1lud 1
42 1 . . . parsed_1lud 1
43 1 . . . parsed_1lud 1
44 1 . . . parsed_1lud 1
45 1 . . . parsed_1lud 1
46 1 . . . parsed_1lud 1
47 1 . . . parsed_1lud 1
48 1 . . . parsed_1lud 1
49 1 . . . parsed_1lud 1
50 1 . . . parsed_1lud 1
51 1 . . . parsed_1lud 1
52 1 . . . parsed_1lud 1
53 1 . . . parsed_1lud 1
54 1 . . . parsed_1lud 1
55 1 . . . parsed_1lud 1
56 1 . . . parsed_1lud 1
57 1 . . . parsed_1lud 1
58 1 . . . parsed_1lud 1
59 1 . . . parsed_1lud 1
60 1 . . . parsed_1lud 1
61 1 . . . parsed_1lud 1
62 1 . . . parsed_1lud 1
63 1 . . . parsed_1lud 1
64 1 . . . parsed_1lud 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 . . . . . . . . . 8 . hn parsed_1lud 1
1 1 2 . . . . . . . . . 12 . o parsed_1lud 1
2 1 1 . . . . . . . . . 8 . n parsed_1lud 1
2 1 2 . . . . . . . . . 12 . o parsed_1lud 1
3 1 1 . . . . . . . . . 9 . hn parsed_1lud 1
3 1 2 . . . . . . . . . 118 . o parsed_1lud 1
3 1 2 . . . . . . . . . 120 . o parsed_1lud 1
4 1 1 . . . . . . . . . 9 . n parsed_1lud 1
4 1 2 . . . . . . . . . 118 . o parsed_1lud 1
4 1 2 . . . . . . . . . 120 . o parsed_1lud 1
5 1 1 . . . . . . . . . 11 . hn parsed_1lud 1
5 1 2 . . . . . . . . . 8 . o parsed_1lud 1
6 1 1 . . . . . . . . . 11 . n parsed_1lud 1
6 1 2 . . . . . . . . . 8 . o parsed_1lud 1
7 1 1 . . . . . . . . . 12 . hn parsed_1lud 1
7 1 2 . . . . . . . . . 8 . od* parsed_1lud 1
8 1 1 . . . . . . . . . 12 . n parsed_1lud 1
8 1 2 . . . . . . . . . 8 . od* parsed_1lud 1
9 1 1 . . . . . . . . . 13 . hn parsed_1lud 1
9 1 2 . . . . . . . . . 126 . o parsed_1lud 1
10 1 1 . . . . . . . . . 13 . n parsed_1lud 1
10 1 2 . . . . . . . . . 126 . o parsed_1lud 1
11 1 1 . . . . . . . . . 14 . hn parsed_1lud 1
11 1 2 . . . . . . . . . 126 . o parsed_1lud 1
12 1 1 . . . . . . . . . 14 . n parsed_1lud 1
12 1 2 . . . . . . . . . 126 . o parsed_1lud 1
13 1 1 . . . . . . . . . 15 . hn parsed_1lud 1
13 1 2 . . . . . . . . . 18 . o parsed_1lud 1
14 1 1 . . . . . . . . . 15 . n parsed_1lud 1
14 1 2 . . . . . . . . . 18 . o parsed_1lud 1
15 1 1 . . . . . . . . . 34 . hn parsed_1lud 1
15 1 2 . . . . . . . . . 31 . o parsed_1lud 1
15 1 2 . . . . . . . . . 32 . o parsed_1lud 1
16 1 1 . . . . . . . . . 34 . n parsed_1lud 1
16 1 2 . . . . . . . . . 31 . o parsed_1lud 1
16 1 2 . . . . . . . . . 32 . o parsed_1lud 1
17 1 1 . . . . . . . . . 35 . hn parsed_1lud 1
17 1 2 . . . . . . . . . 31 . o parsed_1lud 1
17 1 2 . . . . . . . . . 32 . o parsed_1lud 1
18 1 1 . . . . . . . . . 35 . n parsed_1lud 1
18 1 2 . . . . . . . . . 31 . o parsed_1lud 1
18 1 2 . . . . . . . . . 32 . o parsed_1lud 1
19 1 1 . . . . . . . . . 37 . hn parsed_1lud 1
19 1 2 . . . . . . . . . 34 . o parsed_1lud 1
20 1 1 . . . . . . . . . 37 . n parsed_1lud 1
20 1 2 . . . . . . . . . 34 . o parsed_1lud 1
21 1 1 . . . . . . . . . 57 . hn parsed_1lud 1
21 1 2 . . . . . . . . . 54 . o parsed_1lud 1
22 1 1 . . . . . . . . . 57 . n parsed_1lud 1
22 1 2 . . . . . . . . . 54 . o parsed_1lud 1
23 1 1 . . . . . . . . . 73 . hn parsed_1lud 1
23 1 2 . . . . . . . . . 70 . o parsed_1lud 1
24 1 1 . . . . . . . . . 73 . n parsed_1lud 1
24 1 2 . . . . . . . . . 70 . o parsed_1lud 1
25 1 1 . . . . . . . . . 92 . hn parsed_1lud 1
25 1 2 . . . . . . . . . 89 . o parsed_1lud 1
26 1 1 . . . . . . . . . 92 . n parsed_1lud 1
26 1 2 . . . . . . . . . 89 . o parsed_1lud 1
27 1 1 . . . . . . . . . 98 . hn parsed_1lud 1
27 1 2 . . . . . . . . . 40 . o parsed_1lud 1
28 1 1 . . . . . . . . . 98 . n parsed_1lud 1
28 1 2 . . . . . . . . . 40 . o parsed_1lud 1
29 1 1 . . . . . . . . . 128 . hn parsed_1lud 1
29 1 2 . . . . . . . . . 11 . o parsed_1lud 1
30 1 1 . . . . . . . . . 128 . n parsed_1lud 1
30 1 2 . . . . . . . . . 11 . o parsed_1lud 1
31 1 1 . . . . . . . . . 133 . hn parsed_1lud 1
31 1 2 . . . . . . . . . 131 . o parsed_1lud 1
32 1 1 . . . . . . . . . 133 . n parsed_1lud 1
32 1 2 . . . . . . . . . 131 . o parsed_1lud 1
33 1 1 . . . . . . . . . 135 . hn parsed_1lud 1
33 1 2 . . . . . . . . . 132 . o parsed_1lud 1
34 1 1 . . . . . . . . . 135 . n parsed_1lud 1
34 1 2 . . . . . . . . . 132 . o parsed_1lud 1
35 1 1 . . . . . . . . . 136 . hn parsed_1lud 1
35 1 2 . . . . . . . . . 132 . o parsed_1lud 1
36 1 1 . . . . . . . . . 136 . n parsed_1lud 1
36 1 2 . . . . . . . . . 132 . o parsed_1lud 1
37 1 1 . . . . . . . . . 140 . hn parsed_1lud 1
37 1 2 . . . . . . . . . 157 . o parsed_1lud 1
38 1 1 . . . . . . . . . 140 . n parsed_1lud 1
38 1 2 . . . . . . . . . 157 . o parsed_1lud 1
39 1 1 . . . . . . . . . 151 . hn parsed_1lud 1
39 1 2 . . . . . . . . . 148 . o parsed_1lud 1
40 1 1 . . . . . . . . . 151 . n parsed_1lud 1
40 1 2 . . . . . . . . . 148 . o parsed_1lud 1
41 1 1 . . . . . . . . . 152 . hn parsed_1lud 1
41 1 2 . . . . . . . . . 149 . o parsed_1lud 1
42 1 1 . . . . . . . . . 152 . n parsed_1lud 1
42 1 2 . . . . . . . . . 149 . o parsed_1lud 1
43 1 1 . . . . . . . . . 34 . hg1 parsed_1lud 1
43 1 2 . . . . . . . . . 30 . o parsed_1lud 1
44 1 1 . . . . . . . . . 34 . og1 parsed_1lud 1
44 1 2 . . . . . . . . . 30 . o parsed_1lud 1
45 1 1 . . . . . . . . . 116 . hg1 parsed_1lud 1
45 1 2 . . . . . . . . . 26 . od2 parsed_1lud 1
46 1 1 . . . . . . . . . 116 . og1 parsed_1lud 1
46 1 2 . . . . . . . . . 26 . od2 parsed_1lud 1
47 1 1 . . . . . . . . . 170 . h1 parsed_1lud 1
47 1 2 . . . . . . . . . 26 . od1 parsed_1lud 1
48 1 1 . . . . . . . . . 170 . n1 parsed_1lud 1
48 1 2 . . . . . . . . . 26 . od1 parsed_1lud 1
49 1 1 . . . . . . . . . 170 . hn2* parsed_1lud 1
49 1 2 . . . . . . . . . 26 . od2 parsed_1lud 1
50 1 1 . . . . . . . . . 170 . n2 parsed_1lud 1
50 1 2 . . . . . . . . . 26 . od2 parsed_1lud 1
51 1 1 . . . . . . . . . 6 . hn parsed_1lud 1
51 1 2 . . . . . . . . . 168 . o7n parsed_1lud 1
52 1 1 . . . . . . . . . 6 . n parsed_1lud 1
52 1 2 . . . . . . . . . 168 . o7n parsed_1lud 1
53 1 1 . . . . . . . . . 43 . hn parsed_1lud 1
53 1 2 . . . . . . . . . 62 . o parsed_1lud 1
53 1 2 . . . . . . . . . 168 . o4'a parsed_1lud 1
54 1 1 . . . . . . . . . 43 . n parsed_1lud 1
54 1 2 . . . . . . . . . 62 . o parsed_1lud 1
54 1 2 . . . . . . . . . 168 . o4'a parsed_1lud 1
55 1 1 . . . . . . . . . 43 . he parsed_1lud 1
55 1 2 . . . . . . . . . 168 . op#a parsed_1lud 1
56 1 1 . . . . . . . . . 43 . ne parsed_1lud 1
56 1 2 . . . . . . . . . 168 . op#a parsed_1lud 1
57 1 1 . . . . . . . . . 43 . hh11 parsed_1lud 1
57 1 2 . . . . . . . . . 168 . op#a parsed_1lud 1
58 1 1 . . . . . . . . . 43 . nh1 parsed_1lud 1
58 1 2 . . . . . . . . . 168 . op#a parsed_1lud 1
59 1 1 . . . . . . . . . 45 . hn parsed_1lud 1
59 1 2 . . . . . . . . . 168 . o#a parsed_1lud 1
60 1 1 . . . . . . . . . 45 . n parsed_1lud 1
60 1 2 . . . . . . . . . 168 . o#a parsed_1lud 1
61 1 1 . . . . . . . . . 63 . hg1 parsed_1lud 1
61 1 2 . . . . . . . . . 168 . op#a parsed_1lud 1
62 1 1 . . . . . . . . . 63 . og1 parsed_1lud 1
62 1 2 . . . . . . . . . 168 . op#a parsed_1lud 1
63 1 1 . . . . . . . . . 65 . he2# parsed_1lud 1
63 1 2 . . . . . . . . . 168 . op#a parsed_1lud 1
64 1 1 . . . . . . . . . 65 . ne2 parsed_1lud 1
64 1 2 . . . . . . . . . 168 . op#a parsed_1lud 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 . . . . . 2.40 1.60 2.90 parsed_1lud 1
2 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
3 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
4 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
5 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
6 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
7 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
8 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
9 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
10 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
11 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
12 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
13 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
14 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
15 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
16 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
17 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
18 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
19 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
20 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
21 1 . . . . . 2.50 1.70 3.00 parsed_1lud 1
22 1 . . . . . 3.50 2.80 4.00 parsed_1lud 1
23 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
24 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
25 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
26 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
27 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
28 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
29 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
30 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
31 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
32 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
33 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
34 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
35 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
36 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
37 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
38 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
39 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
40 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
41 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
42 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
43 1 . . . . . 2.40 1.60 2.60 parsed_1lud 1
44 1 . . . . . 3.40 2.70 3.60 parsed_1lud 1
45 1 . . . . . 2.40 1.60 2.60 parsed_1lud 1
46 1 . . . . . 3.40 2.70 3.60 parsed_1lud 1
47 1 . . . . . 2.00 1.80 2.20 parsed_1lud 1
48 1 . . . . . 3.00 2.80 3.20 parsed_1lud 1
49 1 . . . . . 2.00 1.80 2.20 parsed_1lud 1
50 1 . . . . . 3.00 2.80 3.20 parsed_1lud 1
51 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
52 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
53 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
54 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
55 1 . . . . . 2.00 1.80 2.20 parsed_1lud 1
56 1 . . . . . 3.00 2.80 3.20 parsed_1lud 1
57 1 . . . . . 2.00 1.80 2.20 parsed_1lud 1
58 1 . . . . . 3.00 2.80 3.20 parsed_1lud 1
59 1 . . . . . 2.40 1.60 2.90 parsed_1lud 1
60 1 . . . . . 3.40 2.70 3.90 parsed_1lud 1
61 1 . . . . . 2.40 1.60 2.60 parsed_1lud 1
62 1 . . . . . 3.40 2.70 3.60 parsed_1lud 1
63 1 . . . . . 2.40 1.60 2.60 parsed_1lud 1
64 1 . . . . . 3.40 2.70 3.60 parsed_1lud 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 turns 1 1 1 8 parsed_1lud 1
2
;
Constraints below are included at the very last stage of refinement
Constraints for Asp-26 - TMP interaction
Polshakov et al., Theochem - J. Mol. Struct., 357, 207-217(1995)
;
49 1 53 66 parsed_1lud 1
3
;
Constraints for DHFR - NADPH interaction
Polshakov et al., J. Mol. Struct., 602/603, 257-267(2002)
;
58 1 59 59 parsed_1lud 1
4 "Gargaro et al., Eur. J. Biochem., 238, 435-439(1996)" 62 1 62 54 parsed_1lud 1
5 "H-bonds detected on comparison between complexes with/without NADPH" 69 1 69 70 parsed_1lud 1
stop_
save_