NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
34103 |
1jdk   |
5136 | cing | 2-parsed | STAR | entry | full | 130 |
data_1jdk_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1jdk
_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_1jdk 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1jdk
_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 1jdk "Master copy" parsed_1jdk
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1jdk
_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 1jdk.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1jdk 1
1 1jdk.mr . . DYANA/DIANA 2 distance NOE simple 65 parsed_1jdk 1
1 1jdk.mr . . DYANA/DIANA 3 distance NOE simple 65 parsed_1jdk 1
1 1jdk.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1jdk 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1jdk
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
*HEADER VIRUS/VIRAL PROTEIN 14-JUN-01 1JDK
*TITLE SOLUTION STRUCTURE OF LACTAM ANALOGUE (EDAP) OF HIV GP41
*TITLE 2 600-612 LOOP.
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: ACETYL GROUP;
*COMPND 3 CHAIN: NULL;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 OTHER_DETAILS: THE PARENT PEPTIDE IWGCSGKLICTTA OCCURS
*SOURCE 4 NATURALLY IN HIV GP41 GLYCOPROTEIN
*KEYWDS CYCLIC PEPTIDE, PEPTIDOMIMETICS, HIV, GP41, LACTAM BOND
*EXPDTA NMR, 25 STRUCTURES
*AUTHOR A.PHAN CHAN DU, D.LIMAL, V.SEMETEY, H.DALI, M.JOLIVET,
*AUTHOR 2 C.DESGRANGES, M.T.CUNG, J.P.BRIAND, M.C.PETIT, S.MULLER
*REVDAT 1 08-JUL-03 1JDK 1 REPROCESSED CONSTRAINTS FILE
*REVDAT 1 01-JUL-03 1JDK 0
;
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1jdk
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type NOE
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_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_1jdk 1
2 1 . . . parsed_1jdk 1
3 1 . . . parsed_1jdk 1
4 1 . . . parsed_1jdk 1
5 1 . . . parsed_1jdk 1
6 1 . . . parsed_1jdk 1
7 1 . . . parsed_1jdk 1
8 1 . . . parsed_1jdk 1
9 1 . . . parsed_1jdk 1
10 1 . . . parsed_1jdk 1
11 1 . . . parsed_1jdk 1
12 1 . . . parsed_1jdk 1
13 1 . . . parsed_1jdk 1
14 1 . . . parsed_1jdk 1
15 1 . . . parsed_1jdk 1
16 1 . . . parsed_1jdk 1
17 1 . . . parsed_1jdk 1
18 1 . . . parsed_1jdk 1
19 1 . . . parsed_1jdk 1
20 1 . . . parsed_1jdk 1
21 1 . . . parsed_1jdk 1
22 1 . . . parsed_1jdk 1
23 1 . . . parsed_1jdk 1
24 1 . . . parsed_1jdk 1
25 1 . . . parsed_1jdk 1
26 1 . . . parsed_1jdk 1
27 1 . . . parsed_1jdk 1
28 1 . . . parsed_1jdk 1
29 1 . . . parsed_1jdk 1
30 1 . . . parsed_1jdk 1
31 1 . . . parsed_1jdk 1
32 1 . . . parsed_1jdk 1
33 1 . . . parsed_1jdk 1
34 1 . . . parsed_1jdk 1
35 1 . . . parsed_1jdk 1
36 1 . . . parsed_1jdk 1
37 1 . . . parsed_1jdk 1
38 1 . . . parsed_1jdk 1
39 1 . . . parsed_1jdk 1
40 1 . . . parsed_1jdk 1
41 1 . . . parsed_1jdk 1
42 1 . . . parsed_1jdk 1
43 1 . . . parsed_1jdk 1
44 1 . . . parsed_1jdk 1
45 1 . . . parsed_1jdk 1
46 1 . . . parsed_1jdk 1
47 1 . . . parsed_1jdk 1
48 1 . . . parsed_1jdk 1
49 1 . . . parsed_1jdk 1
50 1 . . . parsed_1jdk 1
51 1 . . . parsed_1jdk 1
52 1 . . . parsed_1jdk 1
53 1 . . . parsed_1jdk 1
54 1 . . . parsed_1jdk 1
55 1 . . . parsed_1jdk 1
56 1 . . . parsed_1jdk 1
57 1 . . . parsed_1jdk 1
58 1 . . . parsed_1jdk 1
59 1 . . . parsed_1jdk 1
60 1 . . . parsed_1jdk 1
61 1 . . . parsed_1jdk 1
62 1 . . . parsed_1jdk 1
63 1 . . . parsed_1jdk 1
64 1 . . . parsed_1jdk 1
65 1 . . . parsed_1jdk 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 . . . . . . . . . 2 ILE HN parsed_1jdk 1
1 1 2 . . . . . . . . . 2 ILE HA parsed_1jdk 1
2 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 1
2 1 2 . . . . . . . . . 2 ILE HB parsed_1jdk 1
3 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 1
3 1 2 . . . . . . . . . 2 ILE QG2 parsed_1jdk 1
4 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 1
4 1 2 . . . . . . . . . 2 ILE QG1 parsed_1jdk 1
5 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 1
5 1 2 . . . . . . . . . 2 ILE QD1 parsed_1jdk 1
6 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 1
6 1 2 . . . . . . . . . 3 TRP HN parsed_1jdk 1
7 1 1 . . . . . . . . . 2 ILE HA parsed_1jdk 1
7 1 2 . . . . . . . . . 3 TRP HN parsed_1jdk 1
8 1 1 . . . . . . . . . 2 ILE HB parsed_1jdk 1
8 1 2 . . . . . . . . . 3 TRP HN parsed_1jdk 1
9 1 1 . . . . . . . . . 2 ILE QD1 parsed_1jdk 1
9 1 2 . . . . . . . . . 3 TRP HN parsed_1jdk 1
10 1 1 . . . . . . . . . 3 TRP HN parsed_1jdk 1
10 1 2 . . . . . . . . . 3 TRP HA parsed_1jdk 1
11 1 1 . . . . . . . . . 3 TRP HN parsed_1jdk 1
11 1 2 . . . . . . . . . 3 TRP QB parsed_1jdk 1
12 1 1 . . . . . . . . . 3 TRP HN parsed_1jdk 1
12 1 2 . . . . . . . . . 3 TRP HD1 parsed_1jdk 1
13 1 1 . . . . . . . . . 3 TRP HN parsed_1jdk 1
13 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 1
14 1 1 . . . . . . . . . 3 TRP HA parsed_1jdk 1
14 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 1
15 1 1 . . . . . . . . . 3 TRP QB parsed_1jdk 1
15 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 1
16 1 1 . . . . . . . . . 3 TRP HD1 parsed_1jdk 1
16 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 1
17 1 1 . . . . . . . . . 3 TRP HE3 parsed_1jdk 1
17 1 2 . . . . . . . . . 3 TRP HZ2 parsed_1jdk 1
18 1 1 . . . . . . . . . 3 TRP HE3 parsed_1jdk 1
18 1 2 . . . . . . . . . 3 TRP HH2 parsed_1jdk 1
19 1 1 . . . . . . . . . 3 TRP HE3 parsed_1jdk 1
19 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 1
20 1 1 . . . . . . . . . 4 GLY HN parsed_1jdk 1
20 1 2 . . . . . . . . . 4 GLY QA parsed_1jdk 1
21 1 1 . . . . . . . . . 4 GLY QA parsed_1jdk 1
21 1 2 . . . . . . . . . 5 GLS HN parsed_1jdk 1
22 1 1 . . . . . . . . . 5 GLS HN parsed_1jdk 1
22 1 2 . . . . . . . . . 5 GLS HA parsed_1jdk 1
23 1 1 . . . . . . . . . 5 GLS HN parsed_1jdk 1
23 1 2 . . . . . . . . . 5 GLS QB parsed_1jdk 1
24 1 1 . . . . . . . . . 5 GLS HN parsed_1jdk 1
24 1 2 . . . . . . . . . 5 GLS QG parsed_1jdk 1
25 1 1 . . . . . . . . . 5 GLS HA parsed_1jdk 1
25 1 2 . . . . . . . . . 6 SER HN parsed_1jdk 1
26 1 1 . . . . . . . . . 5 GLS QB parsed_1jdk 1
26 1 2 . . . . . . . . . 6 SER HN parsed_1jdk 1
27 1 1 . . . . . . . . . 5 GLS QG parsed_1jdk 1
27 1 2 . . . . . . . . . 6 SER HN parsed_1jdk 1
28 1 1 . . . . . . . . . 5 GLS QG parsed_1jdk 1
28 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 1
29 1 1 . . . . . . . . . 5 GLS QB parsed_1jdk 1
29 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 1
30 1 1 . . . . . . . . . 5 GLS HA parsed_1jdk 1
30 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 1
31 1 1 . . . . . . . . . 6 SER HN parsed_1jdk 1
31 1 2 . . . . . . . . . 6 SER HA parsed_1jdk 1
32 1 1 . . . . . . . . . 6 SER HN parsed_1jdk 1
32 1 2 . . . . . . . . . 6 SER QB parsed_1jdk 1
33 1 1 . . . . . . . . . 6 SER HN parsed_1jdk 1
33 1 2 . . . . . . . . . 7 GLY HN parsed_1jdk 1
34 1 1 . . . . . . . . . 6 SER HA parsed_1jdk 1
34 1 2 . . . . . . . . . 7 GLY HN parsed_1jdk 1
35 1 1 . . . . . . . . . 7 GLY HN parsed_1jdk 1
35 1 2 . . . . . . . . . 7 GLY QA parsed_1jdk 1
36 1 1 . . . . . . . . . 7 GLY HN parsed_1jdk 1
36 1 2 . . . . . . . . . 8 LYS HN parsed_1jdk 1
37 1 1 . . . . . . . . . 7 GLY QA parsed_1jdk 1
37 1 2 . . . . . . . . . 8 LYS HN parsed_1jdk 1
38 1 1 . . . . . . . . . 9 LEU HG parsed_1jdk 1
38 1 2 . . . . . . . . . 10 ILE HN parsed_1jdk 1
39 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 1
39 1 2 . . . . . . . . . 10 ILE HA parsed_1jdk 1
40 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 1
40 1 2 . . . . . . . . . 10 ILE HB parsed_1jdk 1
41 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 1
41 1 2 . . . . . . . . . 10 ILE QG2 parsed_1jdk 1
42 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 1
42 1 2 . . . . . . . . . 10 ILE QD1 parsed_1jdk 1
43 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 1
43 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 1
44 1 1 . . . . . . . . . 10 ILE HA parsed_1jdk 1
44 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 1
45 1 1 . . . . . . . . . 10 ILE HB parsed_1jdk 1
45 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 1
46 1 1 . . . . . . . . . 10 ILE QG2 parsed_1jdk 1
46 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 1
47 1 1 . . . . . . . . . 10 ILE QD1 parsed_1jdk 1
47 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 1
48 1 1 . . . . . . . . . 10 ILE QD1 parsed_1jdk 1
48 1 2 . . . . . . . . . 12 THR HN parsed_1jdk 1
49 1 1 . . . . . . . . . 11 DAB HN parsed_1jdk 1
49 1 2 . . . . . . . . . 11 DAB HA parsed_1jdk 1
50 1 1 . . . . . . . . . 11 DAB HN parsed_1jdk 1
50 1 2 . . . . . . . . . 11 DAB QG parsed_1jdk 1
51 1 1 . . . . . . . . . 11 DAB HN parsed_1jdk 1
51 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 1
52 1 1 . . . . . . . . . 11 DAB HN parsed_1jdk 1
52 1 2 . . . . . . . . . 12 THR HN parsed_1jdk 1
53 1 1 . . . . . . . . . 11 DAB QB parsed_1jdk 1
53 1 2 . . . . . . . . . 12 THR HN parsed_1jdk 1
54 1 1 . . . . . . . . . 11 DAB QG parsed_1jdk 1
54 1 2 . . . . . . . . . 12 THR HN parsed_1jdk 1
55 1 1 . . . . . . . . . 11 DAB HD parsed_1jdk 1
55 1 2 . . . . . . . . . 12 THR HA parsed_1jdk 1
56 1 1 . . . . . . . . . 12 THR HN parsed_1jdk 1
56 1 2 . . . . . . . . . 12 THR HA parsed_1jdk 1
57 1 1 . . . . . . . . . 12 THR HN parsed_1jdk 1
57 1 2 . . . . . . . . . 12 THR HB parsed_1jdk 1
58 1 1 . . . . . . . . . 5 GLS CD parsed_1jdk 1
58 1 2 . . . . . . . . . 11 DAB ND parsed_1jdk 1
59 1 1 . . . . . . . . . 5 GLS OD1 parsed_1jdk 1
59 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 1
60 1 1 . . . . . . . . . 5 GLS CG parsed_1jdk 1
60 1 2 . . . . . . . . . 11 DAB ND parsed_1jdk 1
61 1 1 . . . . . . . . . 5 GLS OD1 parsed_1jdk 1
61 1 2 . . . . . . . . . 11 DAB ND parsed_1jdk 1
62 1 1 . . . . . . . . . 5 GLS CD parsed_1jdk 1
62 1 2 . . . . . . . . . 11 DAB CG parsed_1jdk 1
63 1 1 . . . . . . . . . 5 GLS CD parsed_1jdk 1
63 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 1
64 1 1 . . . . . . . . . 5 GLS CG parsed_1jdk 1
64 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 1
65 1 1 . . . . . . . . . 5 GLS OD1 parsed_1jdk 1
65 1 2 . . . . . . . . . 11 DAB CG parsed_1jdk 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 . . . . . . . 3.80 parsed_1jdk 1
2 1 . . . . . . . 3.80 parsed_1jdk 1
3 1 . . . . . . . 5.50 parsed_1jdk 1
4 1 . . . . . . . 5.50 parsed_1jdk 1
5 1 . . . . . . . 5.50 parsed_1jdk 1
6 1 . . . . . . . 5.50 parsed_1jdk 1
7 1 . . . . . . . 3.20 parsed_1jdk 1
8 1 . . . . . . . 4.80 parsed_1jdk 1
9 1 . . . . . . . 5.50 parsed_1jdk 1
10 1 . . . . . . . 3.80 parsed_1jdk 1
11 1 . . . . . . . 4.14 parsed_1jdk 1
12 1 . . . . . . . 5.50 parsed_1jdk 1
13 1 . . . . . . . 5.50 parsed_1jdk 1
14 1 . . . . . . . 3.20 parsed_1jdk 1
15 1 . . . . . . . 4.26 parsed_1jdk 1
16 1 . . . . . . . 5.50 parsed_1jdk 1
17 1 . . . . . . . 5.50 parsed_1jdk 1
18 1 . . . . . . . 5.50 parsed_1jdk 1
19 1 . . . . . . . 5.50 parsed_1jdk 1
20 1 . . . . . . . 3.77 parsed_1jdk 1
21 1 . . . . . . . 3.67 parsed_1jdk 1
22 1 . . . . . . . 3.80 parsed_1jdk 1
23 1 . . . . . . . 3.98 parsed_1jdk 1
24 1 . . . . . . . 5.50 parsed_1jdk 1
25 1 . . . . . . . 3.30 parsed_1jdk 1
26 1 . . . . . . . 4.48 parsed_1jdk 1
27 1 . . . . . . . 5.50 parsed_1jdk 1
28 1 . . . . . . . 3.80 parsed_1jdk 1
29 1 . . . . . . . 6.50 parsed_1jdk 1
30 1 . . . . . . . 6.50 parsed_1jdk 1
31 1 . . . . . . . 3.80 parsed_1jdk 1
32 1 . . . . . . . 4.80 parsed_1jdk 1
33 1 . . . . . . . 5.50 parsed_1jdk 1
34 1 . . . . . . . 3.80 parsed_1jdk 1
35 1 . . . . . . . 3.30 parsed_1jdk 1
36 1 . . . . . . . 3.80 parsed_1jdk 1
37 1 . . . . . . . 3.80 parsed_1jdk 1
38 1 . . . . . . . 3.80 parsed_1jdk 1
39 1 . . . . . . . 3.80 parsed_1jdk 1
40 1 . . . . . . . 3.80 parsed_1jdk 1
41 1 . . . . . . . 5.50 parsed_1jdk 1
42 1 . . . . . . . 5.50 parsed_1jdk 1
43 1 . . . . . . . 5.50 parsed_1jdk 1
44 1 . . . . . . . 2.80 parsed_1jdk 1
45 1 . . . . . . . 5.50 parsed_1jdk 1
46 1 . . . . . . . 5.50 parsed_1jdk 1
47 1 . . . . . . . 5.50 parsed_1jdk 1
48 1 . . . . . . . 5.50 parsed_1jdk 1
49 1 . . . . . . . 3.80 parsed_1jdk 1
50 1 . . . . . . . 5.57 parsed_1jdk 1
51 1 . . . . . . . 6.50 parsed_1jdk 1
52 1 . . . . . . . 3.80 parsed_1jdk 1
53 1 . . . . . . . 5.50 parsed_1jdk 1
54 1 . . . . . . . 5.50 parsed_1jdk 1
55 1 . . . . . . . 3.80 parsed_1jdk 1
56 1 . . . . . . . 3.80 parsed_1jdk 1
57 1 . . . . . . . 3.80 parsed_1jdk 1
58 1 . . . . . . . 1.34 parsed_1jdk 1
59 1 . . . . . . . 3.17 parsed_1jdk 1
60 1 . . . . . . . 2.36 parsed_1jdk 1
61 1 . . . . . . . 2.24 parsed_1jdk 1
62 1 . . . . . . . 2.43 parsed_1jdk 1
63 1 . . . . . . . 2.06 parsed_1jdk 1
64 1 . . . . . . . 2.46 parsed_1jdk 1
65 1 . . . . . . . 2.71 parsed_1jdk 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 "NMR restraints used for structure calculations of EDAB analogue" 2 1 2 65 parsed_1jdk 1
2 "atom1 atom2 upper limit distance" 5 1 5 51 parsed_1jdk 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1jdk
_Distance_constraint_list.ID 2
_Distance_constraint_list.Constraint_type NOE
_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_1jdk 2
2 1 . . . parsed_1jdk 2
3 1 . . . parsed_1jdk 2
4 1 . . . parsed_1jdk 2
5 1 . . . parsed_1jdk 2
6 1 . . . parsed_1jdk 2
7 1 . . . parsed_1jdk 2
8 1 . . . parsed_1jdk 2
9 1 . . . parsed_1jdk 2
10 1 . . . parsed_1jdk 2
11 1 . . . parsed_1jdk 2
12 1 . . . parsed_1jdk 2
13 1 . . . parsed_1jdk 2
14 1 . . . parsed_1jdk 2
15 1 . . . parsed_1jdk 2
16 1 . . . parsed_1jdk 2
17 1 . . . parsed_1jdk 2
18 1 . . . parsed_1jdk 2
19 1 . . . parsed_1jdk 2
20 1 . . . parsed_1jdk 2
21 1 . . . parsed_1jdk 2
22 1 . . . parsed_1jdk 2
23 1 . . . parsed_1jdk 2
24 1 . . . parsed_1jdk 2
25 1 . . . parsed_1jdk 2
26 1 . . . parsed_1jdk 2
27 1 . . . parsed_1jdk 2
28 1 . . . parsed_1jdk 2
29 1 . . . parsed_1jdk 2
30 1 . . . parsed_1jdk 2
31 1 . . . parsed_1jdk 2
32 1 . . . parsed_1jdk 2
33 1 . . . parsed_1jdk 2
34 1 . . . parsed_1jdk 2
35 1 . . . parsed_1jdk 2
36 1 . . . parsed_1jdk 2
37 1 . . . parsed_1jdk 2
38 1 . . . parsed_1jdk 2
39 1 . . . parsed_1jdk 2
40 1 . . . parsed_1jdk 2
41 1 . . . parsed_1jdk 2
42 1 . . . parsed_1jdk 2
43 1 . . . parsed_1jdk 2
44 1 . . . parsed_1jdk 2
45 1 . . . parsed_1jdk 2
46 1 . . . parsed_1jdk 2
47 1 . . . parsed_1jdk 2
48 1 . . . parsed_1jdk 2
49 1 . . . parsed_1jdk 2
50 1 . . . parsed_1jdk 2
51 1 . . . parsed_1jdk 2
52 1 . . . parsed_1jdk 2
53 1 . . . parsed_1jdk 2
54 1 . . . parsed_1jdk 2
55 1 . . . parsed_1jdk 2
56 1 . . . parsed_1jdk 2
57 1 . . . parsed_1jdk 2
58 1 . . . parsed_1jdk 2
59 1 . . . parsed_1jdk 2
60 1 . . . parsed_1jdk 2
61 1 . . . parsed_1jdk 2
62 1 . . . parsed_1jdk 2
63 1 . . . parsed_1jdk 2
64 1 . . . parsed_1jdk 2
65 1 . . . parsed_1jdk 2
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 . . . . . . . . . 2 ILE HN parsed_1jdk 2
1 1 2 . . . . . . . . . 2 ILE HA parsed_1jdk 2
2 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 2
2 1 2 . . . . . . . . . 2 ILE HB parsed_1jdk 2
3 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 2
3 1 2 . . . . . . . . . 2 ILE QG2 parsed_1jdk 2
4 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 2
4 1 2 . . . . . . . . . 2 ILE QG1 parsed_1jdk 2
5 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 2
5 1 2 . . . . . . . . . 2 ILE QD1 parsed_1jdk 2
6 1 1 . . . . . . . . . 2 ILE HN parsed_1jdk 2
6 1 2 . . . . . . . . . 3 TRP HN parsed_1jdk 2
7 1 1 . . . . . . . . . 2 ILE HA parsed_1jdk 2
7 1 2 . . . . . . . . . 3 TRP HN parsed_1jdk 2
8 1 1 . . . . . . . . . 2 ILE HB parsed_1jdk 2
8 1 2 . . . . . . . . . 3 TRP HN parsed_1jdk 2
9 1 1 . . . . . . . . . 2 ILE QD1 parsed_1jdk 2
9 1 2 . . . . . . . . . 3 TRP HN parsed_1jdk 2
10 1 1 . . . . . . . . . 3 TRP HN parsed_1jdk 2
10 1 2 . . . . . . . . . 3 TRP HA parsed_1jdk 2
11 1 1 . . . . . . . . . 3 TRP HN parsed_1jdk 2
11 1 2 . . . . . . . . . 3 TRP QB parsed_1jdk 2
12 1 1 . . . . . . . . . 3 TRP HN parsed_1jdk 2
12 1 2 . . . . . . . . . 3 TRP HD1 parsed_1jdk 2
13 1 1 . . . . . . . . . 3 TRP HN parsed_1jdk 2
13 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 2
14 1 1 . . . . . . . . . 3 TRP HA parsed_1jdk 2
14 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 2
15 1 1 . . . . . . . . . 3 TRP QB parsed_1jdk 2
15 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 2
16 1 1 . . . . . . . . . 3 TRP HD1 parsed_1jdk 2
16 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 2
17 1 1 . . . . . . . . . 3 TRP HE3 parsed_1jdk 2
17 1 2 . . . . . . . . . 3 TRP HZ2 parsed_1jdk 2
18 1 1 . . . . . . . . . 3 TRP HE3 parsed_1jdk 2
18 1 2 . . . . . . . . . 3 TRP HH2 parsed_1jdk 2
19 1 1 . . . . . . . . . 3 TRP HE3 parsed_1jdk 2
19 1 2 . . . . . . . . . 4 GLY HN parsed_1jdk 2
20 1 1 . . . . . . . . . 4 GLY HN parsed_1jdk 2
20 1 2 . . . . . . . . . 4 GLY QA parsed_1jdk 2
21 1 1 . . . . . . . . . 4 GLY QA parsed_1jdk 2
21 1 2 . . . . . . . . . 5 GLS HN parsed_1jdk 2
22 1 1 . . . . . . . . . 5 GLS HN parsed_1jdk 2
22 1 2 . . . . . . . . . 5 GLS HA parsed_1jdk 2
23 1 1 . . . . . . . . . 5 GLS HN parsed_1jdk 2
23 1 2 . . . . . . . . . 5 GLS QB parsed_1jdk 2
24 1 1 . . . . . . . . . 5 GLS HN parsed_1jdk 2
24 1 2 . . . . . . . . . 5 GLS QG parsed_1jdk 2
25 1 1 . . . . . . . . . 5 GLS HA parsed_1jdk 2
25 1 2 . . . . . . . . . 6 SER HN parsed_1jdk 2
26 1 1 . . . . . . . . . 5 GLS QB parsed_1jdk 2
26 1 2 . . . . . . . . . 6 SER HN parsed_1jdk 2
27 1 1 . . . . . . . . . 5 GLS QG parsed_1jdk 2
27 1 2 . . . . . . . . . 6 SER HN parsed_1jdk 2
28 1 1 . . . . . . . . . 5 GLS QG parsed_1jdk 2
28 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 2
29 1 1 . . . . . . . . . 5 GLS QB parsed_1jdk 2
29 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 2
30 1 1 . . . . . . . . . 5 GLS HA parsed_1jdk 2
30 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 2
31 1 1 . . . . . . . . . 6 SER HN parsed_1jdk 2
31 1 2 . . . . . . . . . 6 SER HA parsed_1jdk 2
32 1 1 . . . . . . . . . 6 SER HN parsed_1jdk 2
32 1 2 . . . . . . . . . 6 SER QB parsed_1jdk 2
33 1 1 . . . . . . . . . 6 SER HN parsed_1jdk 2
33 1 2 . . . . . . . . . 7 GLY HN parsed_1jdk 2
34 1 1 . . . . . . . . . 6 SER HA parsed_1jdk 2
34 1 2 . . . . . . . . . 7 GLY HN parsed_1jdk 2
35 1 1 . . . . . . . . . 7 GLY HN parsed_1jdk 2
35 1 2 . . . . . . . . . 7 GLY QA parsed_1jdk 2
36 1 1 . . . . . . . . . 7 GLY HN parsed_1jdk 2
36 1 2 . . . . . . . . . 8 LYS HN parsed_1jdk 2
37 1 1 . . . . . . . . . 7 GLY QA parsed_1jdk 2
37 1 2 . . . . . . . . . 8 LYS HN parsed_1jdk 2
38 1 1 . . . . . . . . . 9 LEU HG parsed_1jdk 2
38 1 2 . . . . . . . . . 10 ILE HN parsed_1jdk 2
39 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 2
39 1 2 . . . . . . . . . 10 ILE HA parsed_1jdk 2
40 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 2
40 1 2 . . . . . . . . . 10 ILE HB parsed_1jdk 2
41 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 2
41 1 2 . . . . . . . . . 10 ILE QG2 parsed_1jdk 2
42 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 2
42 1 2 . . . . . . . . . 10 ILE QD1 parsed_1jdk 2
43 1 1 . . . . . . . . . 10 ILE HN parsed_1jdk 2
43 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 2
44 1 1 . . . . . . . . . 10 ILE HA parsed_1jdk 2
44 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 2
45 1 1 . . . . . . . . . 10 ILE HB parsed_1jdk 2
45 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 2
46 1 1 . . . . . . . . . 10 ILE QG2 parsed_1jdk 2
46 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 2
47 1 1 . . . . . . . . . 10 ILE QD1 parsed_1jdk 2
47 1 2 . . . . . . . . . 11 DAB HN parsed_1jdk 2
48 1 1 . . . . . . . . . 10 ILE QD1 parsed_1jdk 2
48 1 2 . . . . . . . . . 12 THR HN parsed_1jdk 2
49 1 1 . . . . . . . . . 11 DAB HN parsed_1jdk 2
49 1 2 . . . . . . . . . 11 DAB HA parsed_1jdk 2
50 1 1 . . . . . . . . . 11 DAB HN parsed_1jdk 2
50 1 2 . . . . . . . . . 11 DAB QG parsed_1jdk 2
51 1 1 . . . . . . . . . 11 DAB HN parsed_1jdk 2
51 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 2
52 1 1 . . . . . . . . . 11 DAB HN parsed_1jdk 2
52 1 2 . . . . . . . . . 12 THR HN parsed_1jdk 2
53 1 1 . . . . . . . . . 11 DAB QB parsed_1jdk 2
53 1 2 . . . . . . . . . 12 THR HN parsed_1jdk 2
54 1 1 . . . . . . . . . 11 DAB QG parsed_1jdk 2
54 1 2 . . . . . . . . . 12 THR HN parsed_1jdk 2
55 1 1 . . . . . . . . . 11 DAB HD parsed_1jdk 2
55 1 2 . . . . . . . . . 12 THR HA parsed_1jdk 2
56 1 1 . . . . . . . . . 12 THR HN parsed_1jdk 2
56 1 2 . . . . . . . . . 12 THR HA parsed_1jdk 2
57 1 1 . . . . . . . . . 12 THR HN parsed_1jdk 2
57 1 2 . . . . . . . . . 12 THR HB parsed_1jdk 2
58 1 1 . . . . . . . . . 5 GLS CD parsed_1jdk 2
58 1 2 . . . . . . . . . 11 DAB ND parsed_1jdk 2
59 1 1 . . . . . . . . . 5 GLS OD1 parsed_1jdk 2
59 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 2
60 1 1 . . . . . . . . . 5 GLS CG parsed_1jdk 2
60 1 2 . . . . . . . . . 11 DAB ND parsed_1jdk 2
61 1 1 . . . . . . . . . 5 GLS OD1 parsed_1jdk 2
61 1 2 . . . . . . . . . 11 DAB ND parsed_1jdk 2
62 1 1 . . . . . . . . . 5 GLS CD parsed_1jdk 2
62 1 2 . . . . . . . . . 11 DAB CG parsed_1jdk 2
63 1 1 . . . . . . . . . 5 GLS CD parsed_1jdk 2
63 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 2
64 1 1 . . . . . . . . . 5 GLS CG parsed_1jdk 2
64 1 2 . . . . . . . . . 11 DAB HD parsed_1jdk 2
65 1 1 . . . . . . . . . 5 GLS OD1 parsed_1jdk 2
65 1 2 . . . . . . . . . 11 DAB CG parsed_1jdk 2
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 . . . . . . 2.80 . parsed_1jdk 2
2 1 . . . . . . 2.80 . parsed_1jdk 2
3 1 . . . . . . 3.80 . parsed_1jdk 2
4 1 . . . . . . 4.80 . parsed_1jdk 2
5 1 . . . . . . 4.80 . parsed_1jdk 2
6 1 . . . . . . 3.80 . parsed_1jdk 2
7 1 . . . . . . 2.20 . parsed_1jdk 2
8 1 . . . . . . 3.80 . parsed_1jdk 2
9 1 . . . . . . 4.80 . parsed_1jdk 2
10 1 . . . . . . 2.80 . parsed_1jdk 2
11 1 . . . . . . 3.14 . parsed_1jdk 2
12 1 . . . . . . 4.80 . parsed_1jdk 2
13 1 . . . . . . 3.80 . parsed_1jdk 2
14 1 . . . . . . 2.20 . parsed_1jdk 2
15 1 . . . . . . 3.16 . parsed_1jdk 2
16 1 . . . . . . 4.80 . parsed_1jdk 2
17 1 . . . . . . 4.80 . parsed_1jdk 2
18 1 . . . . . . 3.80 . parsed_1jdk 2
19 1 . . . . . . 4.80 . parsed_1jdk 2
20 1 . . . . . . 2.77 . parsed_1jdk 2
21 1 . . . . . . 2.67 . parsed_1jdk 2
22 1 . . . . . . 2.80 . parsed_1jdk 2
23 1 . . . . . . 2.98 . parsed_1jdk 2
24 1 . . . . . . 4.80 . parsed_1jdk 2
25 1 . . . . . . 2.20 . parsed_1jdk 2
26 1 . . . . . . 3.48 . parsed_1jdk 2
27 1 . . . . . . 4.50 . parsed_1jdk 2
28 1 . . . . . . 2.80 . parsed_1jdk 2
29 1 . . . . . . 1.80 . parsed_1jdk 2
30 1 . . . . . . 1.80 . parsed_1jdk 2
31 1 . . . . . . 2.80 . parsed_1jdk 2
32 1 . . . . . . 3.80 . parsed_1jdk 2
33 1 . . . . . . 3.80 . parsed_1jdk 2
34 1 . . . . . . 2.80 . parsed_1jdk 2
35 1 . . . . . . 2.30 . parsed_1jdk 2
36 1 . . . . . . 2.80 . parsed_1jdk 2
37 1 . . . . . . 2.80 . parsed_1jdk 2
38 1 . . . . . . 2.80 . parsed_1jdk 2
39 1 . . . . . . 2.80 . parsed_1jdk 2
40 1 . . . . . . 2.80 . parsed_1jdk 2
41 1 . . . . . . 3.80 . parsed_1jdk 2
42 1 . . . . . . 3.80 . parsed_1jdk 2
43 1 . . . . . . 3.80 . parsed_1jdk 2
44 1 . . . . . . 1.80 . parsed_1jdk 2
45 1 . . . . . . 3.80 . parsed_1jdk 2
46 1 . . . . . . 4.80 . parsed_1jdk 2
47 1 . . . . . . 4.80 . parsed_1jdk 2
48 1 . . . . . . 4.80 . parsed_1jdk 2
49 1 . . . . . . 2.80 . parsed_1jdk 2
50 1 . . . . . . 3.80 . parsed_1jdk 2
51 1 . . . . . . 5.00 . parsed_1jdk 2
52 1 . . . . . . 2.80 . parsed_1jdk 2
53 1 . . . . . . 3.33 . parsed_1jdk 2
54 1 . . . . . . 4.50 . parsed_1jdk 2
55 1 . . . . . . 2.80 . parsed_1jdk 2
56 1 . . . . . . 2.80 . parsed_1jdk 2
57 1 . . . . . . 2.80 . parsed_1jdk 2
58 1 . . . . . . 1.34 . parsed_1jdk 2
59 1 . . . . . . 3.17 . parsed_1jdk 2
60 1 . . . . . . 2.36 . parsed_1jdk 2
61 1 . . . . . . 2.24 . parsed_1jdk 2
62 1 . . . . . . 2.43 . parsed_1jdk 2
63 1 . . . . . . 2.06 . parsed_1jdk 2
64 1 . . . . . . 2.46 . parsed_1jdk 2
65 1 . . . . . . 2.71 . parsed_1jdk 2
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 "atom1 atom2 lower limit distance" 4 1 4 52 parsed_1jdk 2
stop_
save_
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