Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
53008 | 2oj7 RC | 15157 | cing | 2-parsed | STAR | entry | full | 141 |
data_2oj7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2oj7
_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_2oj7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2oj7
_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 2oj7 "Master copy" parsed_2oj7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2oj7
_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 2oj7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2oj7 1
1 2oj7.mr . . XPLOR/CNS 2 distance NOE simple 51 parsed_2oj7 1
1 2oj7.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 10 parsed_2oj7 1
1 2oj7.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 80 parsed_2oj7 1
1 2oj7.mr . . n/a 5 comment "Not applicable" "Not applicable" 0 parsed_2oj7 1
1 2oj7.mr . . XPLOR/CNS 6 planarity "Not applicable" "Not applicable" 0 parsed_2oj7 1
1 2oj7.mr . . n/a 7 comment "Not applicable" "Not applicable" 0 parsed_2oj7 1
1 2oj7.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2oj7 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_2oj7
_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 RNA 12-JAN-07 2OJ7
*TITLE NMR STRUCTURE OF THE UGUU TETRALOOP OF DUCK EPSILON APICAL
*TITLE 2 STEM LOOP
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: 5'-R(P*GP*CP*UP*GP*UP*UP*GP*U)-3';
*COMPND 3 CHAIN: A;
*COMPND 4 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 SYNTHETIC: YES;
*SOURCE 3 OTHER_DETAILS: THE SEQUENCE OF THIS RNA CAN BE FOUND IN
*SOURCE 4 DUCK HEPATITIS B VIRUS
*KEYWDS HBV, RNA, EPSILON, DUCK, NMR, UGUU, TETRALOOP
*EXPDTA NMR, 10 STRUCTURES
*AUTHOR F.C.GIRARD, O.M.OTTINK, K.A.M.AMPT, M.TESSARI, S.S.WIJMENGA
*REVDAT 2 26-JUN-07 2OJ7 1
*REVDAT 1 22-MAY-07 2OJ7 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2oj7
_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_2oj7 1
2 1 . . . parsed_2oj7 1
3 1 . . . parsed_2oj7 1
4 1 . . . parsed_2oj7 1
5 1 . . . parsed_2oj7 1
6 1 . . . parsed_2oj7 1
7 1 . . . parsed_2oj7 1
8 1 . . . parsed_2oj7 1
9 1 . . . parsed_2oj7 1
10 1 . . . parsed_2oj7 1
11 1 . . . parsed_2oj7 1
12 1 . . . parsed_2oj7 1
13 1 . . . parsed_2oj7 1
14 1 . . . parsed_2oj7 1
15 1 . . . parsed_2oj7 1
16 1 . . . parsed_2oj7 1
17 1 . . . parsed_2oj7 1
18 1 . . . parsed_2oj7 1
19 1 . . . parsed_2oj7 1
20 1 . . . parsed_2oj7 1
21 1 . . . parsed_2oj7 1
22 1 . . . parsed_2oj7 1
23 1 . . . parsed_2oj7 1
24 1 . . . parsed_2oj7 1
25 1 . . . parsed_2oj7 1
26 1 . . . parsed_2oj7 1
27 1 . . . parsed_2oj7 1
28 1 . . . parsed_2oj7 1
29 1 . . . parsed_2oj7 1
30 1 . . . parsed_2oj7 1
31 1 . . . parsed_2oj7 1
32 1 . . . parsed_2oj7 1
33 1 . . . parsed_2oj7 1
34 1 . . . parsed_2oj7 1
35 1 . . . parsed_2oj7 1
36 1 . . . parsed_2oj7 1
37 1 . . . parsed_2oj7 1
38 1 . . . parsed_2oj7 1
39 1 . . . parsed_2oj7 1
40 1 . . . parsed_2oj7 1
41 1 . . . parsed_2oj7 1
42 1 . . . parsed_2oj7 1
43 1 . . . parsed_2oj7 1
44 1 . . . parsed_2oj7 1
45 1 . . . parsed_2oj7 1
46 1 . . . parsed_2oj7 1
47 1 . . . parsed_2oj7 1
48 1 . . . parsed_2oj7 1
49 1 . . . parsed_2oj7 1
50 1 . . . parsed_2oj7 1
51 1 . . . parsed_2oj7 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 . . . . . . . . . 11 . H1' parsed_2oj7 1
1 1 2 . . . . . . . . . 11 . H2' parsed_2oj7 1
2 1 1 . . . . . . . . . 11 . H8 parsed_2oj7 1
2 1 2 . . . . . . . . . 11 . H1' parsed_2oj7 1
3 1 1 . . . . . . . . . 11 . H8 parsed_2oj7 1
3 1 2 . . . . . . . . . 11 . H2' parsed_2oj7 1
4 1 1 . . . . . . . . . 12 . H1' parsed_2oj7 1
4 1 2 . . . . . . . . . 12 . H2' parsed_2oj7 1
5 1 1 . . . . . . . . . 12 . H6 parsed_2oj7 1
5 1 2 . . . . . . . . . 12 . H1' parsed_2oj7 1
6 1 1 . . . . . . . . . 12 . H6 parsed_2oj7 1
6 1 2 . . . . . . . . . 12 . H2' parsed_2oj7 1
7 1 1 . . . . . . . . . 12 . H6 parsed_2oj7 1
7 1 2 . . . . . . . . . 12 . H5 parsed_2oj7 1
8 1 1 . . . . . . . . . 13 . H1' parsed_2oj7 1
8 1 2 . . . . . . . . . 13 . H2' parsed_2oj7 1
9 1 1 . . . . . . . . . 13 . H5 parsed_2oj7 1
9 1 2 . . . . . . . . . 13 . H1' parsed_2oj7 1
10 1 1 . . . . . . . . . 13 . H6 parsed_2oj7 1
10 1 2 . . . . . . . . . 13 . H1' parsed_2oj7 1
11 1 1 . . . . . . . . . 13 . H6 parsed_2oj7 1
11 1 2 . . . . . . . . . 13 . H2' parsed_2oj7 1
12 1 1 . . . . . . . . . 13 . H6 parsed_2oj7 1
12 1 2 . . . . . . . . . 13 . H5 parsed_2oj7 1
13 1 1 . . . . . . . . . 14 . H1' parsed_2oj7 1
13 1 2 . . . . . . . . . 14 . H2' parsed_2oj7 1
14 1 1 . . . . . . . . . 14 . H8 parsed_2oj7 1
14 1 2 . . . . . . . . . 14 . H1' parsed_2oj7 1
15 1 1 . . . . . . . . . 14 . H8 parsed_2oj7 1
15 1 2 . . . . . . . . . 14 . H2' parsed_2oj7 1
16 1 1 . . . . . . . . . 15 . H1' parsed_2oj7 1
16 1 2 . . . . . . . . . 15 . H2' parsed_2oj7 1
17 1 1 . . . . . . . . . 15 . H1' parsed_2oj7 1
17 1 2 . . . . . . . . . 15 . H3' parsed_2oj7 1
18 1 1 . . . . . . . . . 15 . H1' parsed_2oj7 1
18 1 2 . . . . . . . . . 15 . H5 parsed_2oj7 1
19 1 1 . . . . . . . . . 15 . H6 parsed_2oj7 1
19 1 2 . . . . . . . . . 15 . H1' parsed_2oj7 1
20 1 1 . . . . . . . . . 15 . H6 parsed_2oj7 1
20 1 2 . . . . . . . . . 15 . H2' parsed_2oj7 1
21 1 1 . . . . . . . . . 15 . H6 parsed_2oj7 1
21 1 2 . . . . . . . . . 15 . H5 parsed_2oj7 1
22 1 1 . . . . . . . . . 16 . H1' parsed_2oj7 1
22 1 2 . . . . . . . . . 16 . H2' parsed_2oj7 1
23 1 1 . . . . . . . . . 16 . H1' parsed_2oj7 1
23 1 2 . . . . . . . . . 16 . H3' parsed_2oj7 1
24 1 1 . . . . . . . . . 16 . H6 parsed_2oj7 1
24 1 2 . . . . . . . . . 16 . H5 parsed_2oj7 1
25 1 1 . . . . . . . . . 17 . H8 parsed_2oj7 1
25 1 2 . . . . . . . . . 17 . H1' parsed_2oj7 1
26 1 1 . . . . . . . . . 18 . H1' parsed_2oj7 1
26 1 2 . . . . . . . . . 18 . H5 parsed_2oj7 1
27 1 1 . . . . . . . . . 18 . H6 parsed_2oj7 1
27 1 2 . . . . . . . . . 18 . H1' parsed_2oj7 1
28 1 1 . . . . . . . . . 18 . H6 parsed_2oj7 1
28 1 2 . . . . . . . . . 18 . H2' parsed_2oj7 1
29 1 1 . . . . . . . . . 18 . H6 parsed_2oj7 1
29 1 2 . . . . . . . . . 18 . H5 parsed_2oj7 1
30 1 1 . . . . . . . . . 11 . H8 parsed_2oj7 1
30 1 2 . . . . . . . . . 12 . H5 parsed_2oj7 1
31 1 1 . . . . . . . . . 12 . H6 parsed_2oj7 1
31 1 2 . . . . . . . . . 11 . H1' parsed_2oj7 1
32 1 1 . . . . . . . . . 12 . H6 parsed_2oj7 1
32 1 2 . . . . . . . . . 11 . H2' parsed_2oj7 1
33 1 1 . . . . . . . . . 12 . H6 parsed_2oj7 1
33 1 2 . . . . . . . . . 13 . H5 parsed_2oj7 1
34 1 1 . . . . . . . . . 13 . H5 parsed_2oj7 1
34 1 2 . . . . . . . . . 12 . H5 parsed_2oj7 1
35 1 1 . . . . . . . . . 13 . H6 parsed_2oj7 1
35 1 2 . . . . . . . . . 12 . H1' parsed_2oj7 1
36 1 1 . . . . . . . . . 13 . H6 parsed_2oj7 1
36 1 2 . . . . . . . . . 12 . H2' parsed_2oj7 1
37 1 1 . . . . . . . . . 13 . H6 parsed_2oj7 1
37 1 2 . . . . . . . . . 12 . H5 parsed_2oj7 1
38 1 1 . . . . . . . . . 13 . H6 parsed_2oj7 1
38 1 2 . . . . . . . . . 12 . H6 parsed_2oj7 1
39 1 1 . . . . . . . . . 14 . H8 parsed_2oj7 1
39 1 2 . . . . . . . . . 13 . H1' parsed_2oj7 1
40 1 1 . . . . . . . . . 14 . H8 parsed_2oj7 1
40 1 2 . . . . . . . . . 13 . H2' parsed_2oj7 1
41 1 1 . . . . . . . . . 14 . H8 parsed_2oj7 1
41 1 2 . . . . . . . . . 13 . H6 parsed_2oj7 1
42 1 1 . . . . . . . . . 16 . H6 parsed_2oj7 1
42 1 2 . . . . . . . . . 17 . H8 parsed_2oj7 1
43 1 1 . . . . . . . . . 17 . H1' parsed_2oj7 1
43 1 2 . . . . . . . . . 13 . H1' parsed_2oj7 1
44 1 1 . . . . . . . . . 17 . H8 parsed_2oj7 1
44 1 2 . . . . . . . . . 16 . H1' parsed_2oj7 1
45 1 1 . . . . . . . . . 17 . H8 parsed_2oj7 1
45 1 2 . . . . . . . . . 18 . H5 parsed_2oj7 1
46 1 1 . . . . . . . . . 18 . H6 parsed_2oj7 1
46 1 2 . . . . . . . . . 17 . H1' parsed_2oj7 1
47 1 1 . . . . . . . . . 18 . H6 parsed_2oj7 1
47 1 2 . . . . . . . . . 17 . H8 parsed_2oj7 1
48 1 1 . . . . . . . . . 17 . H1 parsed_2oj7 1
48 1 2 . . . . . . . . . 11 . H1 parsed_2oj7 1
49 1 1 . . . . . . . . . 17 . H1 parsed_2oj7 1
49 1 2 . . . . . . . . . 13 . H3 parsed_2oj7 1
50 1 1 . . . . . . . . . 17 . H1 parsed_2oj7 1
50 1 2 . . . . . . . . . 18 . H3 parsed_2oj7 1
51 1 1 . . . . . . . . . 18 . H3 parsed_2oj7 1
51 1 2 . . . . . . . . . 11 . H1 parsed_2oj7 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 . . . . . 2.23 1.23 3.23 parsed_2oj7 1
2 1 . . . . . 3.5 2.5 4.5 parsed_2oj7 1
3 1 . . . . . 4.2 3.2 5.2 parsed_2oj7 1
4 1 . . . . . 2.08 1.08 3.08 parsed_2oj7 1
5 1 . . . . . 3.7 2.7 4.7 parsed_2oj7 1
6 1 . . . . . 3.4 2.4 4.4 parsed_2oj7 1
7 1 . . . . . 2.45 1.79 3.74 parsed_2oj7 1
8 1 . . . . . 2.10 1.10 3.10 parsed_2oj7 1
9 1 . . . . . 4.7 3.7 5.7 parsed_2oj7 1
10 1 . . . . . 3.2 2.2 4.2 parsed_2oj7 1
11 1 . . . . . 3.6 2.6 4.6 parsed_2oj7 1
12 1 . . . . . 2.45 1.79 3.74 parsed_2oj7 1
13 1 . . . . . 2.44 1.44 3.44 parsed_2oj7 1
14 1 . . . . . 2.9 1.9 3.9 parsed_2oj7 1
15 1 . . . . . 3.4 2.4 4.4 parsed_2oj7 1
16 1 . . . . . 2.24 1.24 3.24 parsed_2oj7 1
17 1 . . . . . 3.8 2.8 4.8 parsed_2oj7 1
18 1 . . . . . 4.9 3.9 5.9 parsed_2oj7 1
19 1 . . . . . 3.1 2.1 4.1 parsed_2oj7 1
20 1 . . . . . 2.8 1.3 4.3 parsed_2oj7 1
21 1 . . . . . 2.45 1.79 3.74 parsed_2oj7 1
22 1 . . . . . 2.34 1.34 3.34 parsed_2oj7 1
23 1 . . . . . 3.9 2.9 4.9 parsed_2oj7 1
24 1 . . . . . 2.45 1.79 3.74 parsed_2oj7 1
25 1 . . . . . 4.0 3.0 5.0 parsed_2oj7 1
26 1 . . . . . 4.9 3.9 5.9 parsed_2oj7 1
27 1 . . . . . 3.6 2.6 4.6 parsed_2oj7 1
28 1 . . . . . 3.7 2.7 4.7 parsed_2oj7 1
29 1 . . . . . 2.45 1.79 3.74 parsed_2oj7 1
30 1 . . . . . 3.5 2.5 4.5 parsed_2oj7 1
31 1 . . . . . 4.5 3.5 5.5 parsed_2oj7 1
32 1 . . . . . 2.29 1.29 3.29 parsed_2oj7 1
33 1 . . . . . 3.5 2.5 4.5 parsed_2oj7 1
34 1 . . . . . 3.5 2.0 4.5 parsed_2oj7 1
35 1 . . . . . 4.5 3.0 5.5 parsed_2oj7 1
36 1 . . . . . 2.26 1.26 3.26 parsed_2oj7 1
37 1 . . . . . 6 5 7 parsed_2oj7 1
38 1 . . . . . 5 4 6 parsed_2oj7 1
39 1 . . . . . 4.5 3.5 5.5 parsed_2oj7 1
40 1 . . . . . 2.2 1.2 3.2 parsed_2oj7 1
41 1 . . . . . 5 4 6 parsed_2oj7 1
42 1 . . . . . 3.5 2.5 3.8 parsed_2oj7 1
43 1 . . . . . 4.5 3.5 5.5 parsed_2oj7 1
44 1 . . . . . 4.5 3.5 5.5 parsed_2oj7 1
45 1 . . . . . 3.5 2.5 4.5 parsed_2oj7 1
46 1 . . . . . 4.5 3.5 5.5 parsed_2oj7 1
47 1 . . . . . 5 4 6 parsed_2oj7 1
48 1 . . . . . 3 2 5 parsed_2oj7 1
49 1 . . . . . 3 2 5 parsed_2oj7 1
50 1 . . . . . 3 2 5 parsed_2oj7 1
51 1 . . . . . 3 2 5 parsed_2oj7 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 "****************************Intra NOE restraints***************************************************" 2 1 2 101 parsed_2oj7 1
2 "****************************Inter NOE restraints***************************************************" 32 1 32 101 parsed_2oj7 1
stop_
save_
save_CNS/XPLOR_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2oj7
_Distance_constraint_list.ID 2
_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_2oj7 2
2 1 . . . parsed_2oj7 2
3 1 . . . parsed_2oj7 2
4 1 . . . parsed_2oj7 2
5 1 . . . parsed_2oj7 2
6 1 . . . parsed_2oj7 2
7 1 . . . parsed_2oj7 2
8 1 . . . parsed_2oj7 2
9 1 . . . parsed_2oj7 2
10 1 . . . parsed_2oj7 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 . . . . . . . . . 18 . O4 parsed_2oj7 2
1 1 2 . . . . . . . . . 11 . N2 parsed_2oj7 2
2 1 1 . . . . . . . . . 18 . N3 parsed_2oj7 2
2 1 2 . . . . . . . . . 11 . N1 parsed_2oj7 2
3 1 1 . . . . . . . . . 18 . O2 parsed_2oj7 2
3 1 2 . . . . . . . . . 11 . O6 parsed_2oj7 2
4 1 1 . . . . . . . . . 18 . O2 parsed_2oj7 2
4 1 2 . . . . . . . . . 11 . N2 parsed_2oj7 2
5 1 1 . . . . . . . . . 18 . O4 parsed_2oj7 2
5 1 2 . . . . . . . . . 11 . O6 parsed_2oj7 2
6 1 1 . . . . . . . . . 12 . N4 parsed_2oj7 2
6 1 2 . . . . . . . . . 17 . O6 parsed_2oj7 2
7 1 1 . . . . . . . . . 12 . N3 parsed_2oj7 2
7 1 2 . . . . . . . . . 17 . N1 parsed_2oj7 2
8 1 1 . . . . . . . . . 12 . O2 parsed_2oj7 2
8 1 2 . . . . . . . . . 17 . N2 parsed_2oj7 2
9 1 1 . . . . . . . . . 12 . N4 parsed_2oj7 2
9 1 2 . . . . . . . . . 17 . N2 parsed_2oj7 2
10 1 1 . . . . . . . . . 12 . O2 parsed_2oj7 2
10 1 2 . . . . . . . . . 17 . O6 parsed_2oj7 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 . . . . . 7.27 7.12 7.42 parsed_2oj7 2
2 1 . . . . . 3.54 3.39 3.69 parsed_2oj7 2
3 1 . . . . . 3.50 3.35 3.65 parsed_2oj7 2
4 1 . . . . . 3.40 3.25 3.55 parsed_2oj7 2
5 1 . . . . . 3.56 3.41 3.71 parsed_2oj7 2
6 1 . . . . . 2.91 2.76 3.06 parsed_2oj7 2
7 1 . . . . . 2.95 2.80 3.10 parsed_2oj7 2
8 1 . . . . . 2.86 2.71 3.01 parsed_2oj7 2
9 1 . . . . . 4.90 4.40 5.40 parsed_2oj7 2
10 1 . . . . . 5.80 5.30 6.30 parsed_2oj7 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 "****************************H bonds restraints*****************************************************" 1 1 1 101 parsed_2oj7 2
stop_
save_
save_CNS/XPLOR_dihedral_4
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_2oj7
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 4
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -205 -125 . . 11 . O4' . 11 . C1' . 11 . N9 . 11 . C4 parsed_2oj7 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -205 -125 . . 12 . O4' . 12 . C1' . 12 . N1 . 12 . C2 parsed_2oj7 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -205 -125 . . 13 . O4' . 13 . C1' . 13 . N1 . 13 . C2 parsed_2oj7 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -205 -125 . . 14 . O4' . 14 . C1' . 14 . N9 . 14 . C4 parsed_2oj7 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -205 -125 . . 15 . O4' . 15 . C1' . 15 . N1 . 15 . C2 parsed_2oj7 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -205 -125 . . 16 . O4' . 16 . C1' . 16 . N1 . 16 . C2 parsed_2oj7 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -205 -125 . . 17 . O4' . 17 . C1' . 17 . N9 . 17 . C4 parsed_2oj7 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -205 -125 . . 18 . O4' . 18 . C1' . 18 . N1 . 18 . C2 parsed_2oj7 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -239.9 -119.9 . . 11 . P . 11 . O5' . 11 . C5' . 11 . C4' parsed_2oj7 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -12.6 107.4 . . 11 . O5' . 11 . C5' . 11 . C4' . 11 . C3' parsed_2oj7 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23.5 143.5 . . 11 . C5' . 11 . C4' . 11 . C3' . 11 . O3' parsed_2oj7 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -211.9 -91.9 . . 11 . C4' . 11 . C3' . 11 . O3' . 12 . P parsed_2oj7 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.6 -13.6 . . 11 . C3' . 11 . O3' . 12 . P . 12 . O5' parsed_2oj7 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.1 -2.1 . . 11 . O3' . 12 . P . 12 . O5' . 12 . C5' parsed_2oj7 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -239.9 -119.9 . . 12 . P . 12 . O5' . 12 . C5' . 12 . C4' parsed_2oj7 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -12.6 107.4 . . 12 . O5' . 12 . C5' . 12 . C4' . 12 . C3' parsed_2oj7 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23.5 143.5 . . 12 . C5' . 12 . C4' . 12 . C3' . 12 . O3' parsed_2oj7 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -211.9 -91.9 . . 12 . C4' . 12 . C3' . 12 . O3' . 13 . P parsed_2oj7 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.6 -13.6 . . 12 . C3' . 12 . O3' . 13 . P . 13 . O5' parsed_2oj7 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.1 -2.1 . . 12 . O3' . 13 . P . 13 . O5' . 13 . C5' parsed_2oj7 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -239.9 -119.9 . . 13 . P . 13 . O5' . 13 . C5' . 13 . C4' parsed_2oj7 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -12.6 107.4 . . 13 . O5' . 13 . C5' . 13 . C4' . 13 . C3' parsed_2oj7 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23.5 143.5 . . 13 . C5' . 13 . C4' . 13 . C3' . 13 . O3' parsed_2oj7 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -211.9 -91.9 . . 13 . C4' . 13 . C3' . 13 . O3' . 14 . P parsed_2oj7 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.6 -13.6 . . 13 . C3' . 13 . O3' . 14 . P . 14 . O5' parsed_2oj7 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.1 -2.1 . . 13 . O3' . 14 . P . 14 . O5' . 14 . C5' parsed_2oj7 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -239.9 -119.9 . . 14 . P . 14 . O5' . 14 . C5' . 14 . C4' parsed_2oj7 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -12.6 107.4 . . 14 . O5' . 14 . C5' . 14 . C4' . 14 . C3' parsed_2oj7 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -211.9 -91.9 . . 16 . C4' . 16 . C3' . 16 . O3' . 17 . P parsed_2oj7 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.6 -13.6 . . 16 . C3' . 16 . O3' . 17 . P . 17 . O5' parsed_2oj7 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.1 -2.1 . . 16 . O3' . 17 . P . 17 . O5' . 17 . C5' parsed_2oj7 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -239.9 -119.9 . . 17 . P . 17 . O5' . 17 . C5' . 17 . C4' parsed_2oj7 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -12.6 107.4 . . 17 . O5' . 17 . C5' . 17 . C4' . 17 . C3' parsed_2oj7 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23.5 143.5 . . 17 . C5' . 17 . C4' . 17 . C3' . 17 . O3' parsed_2oj7 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -211.9 -91.9 . . 17 . C4' . 17 . C3' . 17 . O3' . 18 . P parsed_2oj7 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -133.6 -13.6 . . 17 . C3' . 17 . O3' . 18 . P . 18 . O5' parsed_2oj7 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -122.1 -2.1 . . 17 . O3' . 18 . P . 18 . O5' . 18 . C5' parsed_2oj7 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -239.9 -119.9 . . 18 . P . 18 . O5' . 18 . C5' . 18 . C4' parsed_2oj7 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -12.6 107.4 . . 18 . O5' . 18 . C5' . 18 . C4' . 18 . C3' parsed_2oj7 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 23.5 143.5 . . 18 . C5' . 18 . C4' . 18 . C3' . 18 . O3' parsed_2oj7 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.8 4.2 . . 11 . O4' . 11 . C1' . 11 . C2' . 11 . C3' parsed_2oj7 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.7 97.3 . . 11 . C1' . 11 . C2' . 11 . C3' . 11 . C4' parsed_2oj7 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.2 23.8 . . 11 . C2' . 11 . C3' . 11 . C4' . 11 . O4' parsed_2oj7 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -9.3 50.7 . . 11 . C3' . 11 . C4' . 11 . O4' . 11 . C1' parsed_2oj7 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -26.6 33.4 . . 11 . C4' . 11 . O4' . 11 . C1' . 11 . C2' parsed_2oj7 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.8 4.2 . . 12 . O4' . 12 . C1' . 12 . C2' . 12 . C3' parsed_2oj7 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.7 97.3 . . 12 . C1' . 12 . C2' . 12 . C3' . 12 . C4' parsed_2oj7 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.2 23.8 . . 12 . C2' . 12 . C3' . 12 . C4' . 12 . O4' parsed_2oj7 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -9.3 50.7 . . 12 . C3' . 12 . C4' . 12 . O4' . 12 . C1' parsed_2oj7 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -26.6 33.4 . . 12 . C4' . 12 . O4' . 12 . C1' . 12 . C2' parsed_2oj7 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.8 4.2 . . 13 . O4' . 13 . C1' . 13 . C2' . 13 . C3' parsed_2oj7 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.7 97.3 . . 13 . C1' . 13 . C2' . 13 . C3' . 13 . C4' parsed_2oj7 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.2 23.8 . . 13 . C2' . 13 . C3' . 13 . C4' . 13 . O4' parsed_2oj7 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -9.3 50.7 . . 13 . C3' . 13 . C4' . 13 . O4' . 13 . C1' parsed_2oj7 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -26.6 33.4 . . 13 . C4' . 13 . O4' . 13 . C1' . 13 . C2' parsed_2oj7 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -4.7 55.3 . . 14 . O4' . 14 . C1' . 14 . C2' . 14 . C3' parsed_2oj7 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.8 25.2 . . 14 . C1' . 14 . C2' . 14 . C3' . 14 . C4' parsed_2oj7 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -25.2 94.8 . . 14 . C2' . 14 . C3' . 14 . C4' . 14 . O4' parsed_2oj7 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.1 9.9 . . 14 . C3' . 14 . C4' . 14 . O4' . 14 . C1' parsed_2oj7 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -33.9 26.1 . . 14 . C4' . 14 . O4' . 14 . C1' . 14 . C2' parsed_2oj7 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -4.7 55.3 . . 15 . O4' . 15 . C1' . 15 . C2' . 15 . C3' parsed_2oj7 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.8 25.2 . . 15 . C1' . 15 . C2' . 15 . C3' . 15 . C4' parsed_2oj7 1
63 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -25.2 94.8 . . 15 . C2' . 15 . C3' . 15 . C4' . 15 . O4' parsed_2oj7 1
64 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.1 9.9 . . 15 . C3' . 15 . C4' . 15 . O4' . 15 . C1' parsed_2oj7 1
65 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -33.9 26.1 . . 15 . C4' . 15 . O4' . 15 . C1' . 15 . C2' parsed_2oj7 1
66 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -4.7 55.3 . . 16 . O4' . 16 . C1' . 16 . C2' . 16 . C3' parsed_2oj7 1
67 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -94.8 25.2 . . 16 . C1' . 16 . C2' . 16 . C3' . 16 . C4' parsed_2oj7 1
68 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -25.2 94.8 . . 16 . C2' . 16 . C3' . 16 . C4' . 16 . O4' parsed_2oj7 1
69 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -50.1 9.9 . . 16 . C3' . 16 . C4' . 16 . O4' . 16 . C1' parsed_2oj7 1
70 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -33.9 26.1 . . 16 . C4' . 16 . O4' . 16 . C1' . 16 . C2' parsed_2oj7 1
71 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.8 4.2 . . 17 . O4' . 17 . C1' . 17 . C2' . 17 . C3' parsed_2oj7 1
72 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.7 97.3 . . 17 . C1' . 17 . C2' . 17 . C3' . 17 . C4' parsed_2oj7 1
73 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.2 23.8 . . 17 . C2' . 17 . C3' . 17 . C4' . 17 . O4' parsed_2oj7 1
74 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -9.3 50.7 . . 17 . C3' . 17 . C4' . 17 . O4' . 17 . C1' parsed_2oj7 1
75 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -26.6 33.4 . . 17 . C4' . 17 . O4' . 17 . C1' . 17 . C2' parsed_2oj7 1
76 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -55.8 4.2 . . 18 . O4' . 18 . C1' . 18 . C2' . 18 . C3' parsed_2oj7 1
77 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -22.7 97.3 . . 18 . C1' . 18 . C2' . 18 . C3' . 18 . C4' parsed_2oj7 1
78 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -96.2 23.8 . . 18 . C2' . 18 . C3' . 18 . C4' . 18 . O4' parsed_2oj7 1
79 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -9.3 50.7 . . 18 . C3' . 18 . C4' . 18 . O4' . 18 . C1' parsed_2oj7 1
80 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -26.6 33.4 . . 18 . C4' . 18 . O4' . 18 . C1' . 18 . C2' parsed_2oj7 1
stop_
loop_
_TA_constraint_comment_org.ID
_TA_constraint_comment_org.Comment_text
_TA_constraint_comment_org.Comment_begin_line
_TA_constraint_comment_org.Comment_begin_column
_TA_constraint_comment_org.Comment_end_line
_TA_constraint_comment_org.Comment_end_column
_TA_constraint_comment_org.Entry_ID
_TA_constraint_comment_org.Torsion_angle_constraint_list_ID
1 "****************************Chi angle restraints***************************************************" 1 1 1 101 parsed_2oj7 1
2 "****************************Backbone glycosidic torsian angles restraints**************************" 18 1 18 101 parsed_2oj7 1
3 "****************************Sugar pucker restraints************************************************" 83 1 83 101 parsed_2oj7 1
stop_
save_
save_MR_file_comment_5
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2oj7
_Org_constr_file_comment.ID 2
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 5
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment "*****************************Planarity restraints***************************************************"
save_
save_MR_file_comment_7
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2oj7
_Org_constr_file_comment.ID 3
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 7
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment ****************************************************************************************************
save_