NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
36989 |
1oqp   |
5722 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 26 |
data_1oqp_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1oqp
_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_1oqp 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1oqp
_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 1oqp "Master copy" parsed_1oqp
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1oqp
_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 1oqp.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1oqp 1
1 1oqp.mr . . DYANA/DIANA 2 distance NOE simple 1641 parsed_1oqp 1
1 1oqp.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 26 parsed_1oqp 1
1 1oqp.mr . . DYANA/DIANA 4 distance "hydrogen bond" simple 0 parsed_1oqp 1
1 1oqp.mr . . DYANA/DIANA 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1oqp 1
1 1oqp.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1oqp 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1oqp
_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_1oqp 1
2 1 . . . parsed_1oqp 1
3 1 . . . parsed_1oqp 1
4 1 . . . parsed_1oqp 1
5 1 . . . parsed_1oqp 1
6 1 . . . parsed_1oqp 1
7 1 . . . parsed_1oqp 1
8 1 . . . parsed_1oqp 1
9 1 . . . parsed_1oqp 1
10 1 . . . parsed_1oqp 1
11 1 . . . parsed_1oqp 1
12 1 . . . parsed_1oqp 1
13 1 . . . parsed_1oqp 1
14 1 . . . parsed_1oqp 1
15 1 . . . parsed_1oqp 1
16 1 . . . parsed_1oqp 1
17 1 . . . parsed_1oqp 1
18 1 . . . parsed_1oqp 1
19 1 . . . parsed_1oqp 1
20 1 . . . parsed_1oqp 1
21 1 . . . parsed_1oqp 1
22 1 . . . parsed_1oqp 1
23 1 . . . parsed_1oqp 1
24 1 . . . parsed_1oqp 1
25 1 . . . parsed_1oqp 1
26 1 . . . parsed_1oqp 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 . . . . . . . . . 110 PHE HN parsed_1oqp 1
1 1 2 . . . . . . . . . 106 ALA O parsed_1oqp 1
2 1 1 . . . . . . . . . 118 ILE HN parsed_1oqp 1
2 1 2 . . . . . . . . . 154 ILE O parsed_1oqp 1
3 1 1 . . . . . . . . . 119 THR HN parsed_1oqp 1
3 1 2 . . . . . . . . . 122 ASP- OD1 parsed_1oqp 1
4 1 1 . . . . . . . . . 123 LEU HN parsed_1oqp 1
4 1 2 . . . . . . . . . 119 THR O parsed_1oqp 1
5 1 1 . . . . . . . . . 124 ARG+ HN parsed_1oqp 1
5 1 2 . . . . . . . . . 120 ILE O parsed_1oqp 1
6 1 1 . . . . . . . . . 126 VAL HN parsed_1oqp 1
6 1 2 . . . . . . . . . 122 ASP- O parsed_1oqp 1
7 1 1 . . . . . . . . . 127 ALA HN parsed_1oqp 1
7 1 2 . . . . . . . . . 123 LEU O parsed_1oqp 1
8 1 1 . . . . . . . . . 138 GLU- HN parsed_1oqp 1
8 1 2 . . . . . . . . . 135 THR OG1 parsed_1oqp 1
9 1 1 . . . . . . . . . 139 LEU HN parsed_1oqp 1
9 1 2 . . . . . . . . . 135 THR O parsed_1oqp 1
10 1 1 . . . . . . . . . 140 GLN HN parsed_1oqp 1
10 1 2 . . . . . . . . . 136 GLU- O parsed_1oqp 1
11 1 1 . . . . . . . . . 141 GLU- HN parsed_1oqp 1
11 1 2 . . . . . . . . . 137 GLU- O parsed_1oqp 1
12 1 1 . . . . . . . . . 142 MET HN parsed_1oqp 1
12 1 2 . . . . . . . . . 138 GLU- O parsed_1oqp 1
13 1 1 . . . . . . . . . 143 ILE HN parsed_1oqp 1
13 1 2 . . . . . . . . . 139 LEU O parsed_1oqp 1
14 1 1 . . . . . . . . . 144 ALA HN parsed_1oqp 1
14 1 2 . . . . . . . . . 140 GLN O parsed_1oqp 1
15 1 1 . . . . . . . . . 146 ALA HN parsed_1oqp 1
15 1 2 . . . . . . . . . 142 MET O parsed_1oqp 1
16 1 1 . . . . . . . . . 148 ARG+ HN parsed_1oqp 1
16 1 2 . . . . . . . . . 158 GLU- OE2 parsed_1oqp 1
17 1 1 . . . . . . . . . 151 ASP- HN parsed_1oqp 1
17 1 2 . . . . . . . . . 149 ASN OD1 parsed_1oqp 1
18 1 1 . . . . . . . . . 153 GLU- HN parsed_1oqp 1
18 1 2 . . . . . . . . . 151 ASP- OD1 parsed_1oqp 1
19 1 1 . . . . . . . . . 154 ILE HN parsed_1oqp 1
19 1 2 . . . . . . . . . 118 ILE O parsed_1oqp 1
20 1 1 . . . . . . . . . 155 ASP- HN parsed_1oqp 1
20 1 2 . . . . . . . . . 158 GLU- OE1 parsed_1oqp 1
21 1 1 . . . . . . . . . 158 GLU- HN parsed_1oqp 1
21 1 2 . . . . . . . . . 155 ASP- OD1 parsed_1oqp 1
22 1 1 . . . . . . . . . 159 PHE HN parsed_1oqp 1
22 1 2 . . . . . . . . . 155 ASP- O parsed_1oqp 1
23 1 1 . . . . . . . . . 160 ILE HN parsed_1oqp 1
23 1 2 . . . . . . . . . 156 GLU- O parsed_1oqp 1
24 1 1 . . . . . . . . . 161 ARG+ HN parsed_1oqp 1
24 1 2 . . . . . . . . . 157 ASP- O parsed_1oqp 1
25 1 1 . . . . . . . . . 162 ILE HN parsed_1oqp 1
25 1 2 . . . . . . . . . 158 GLU- O parsed_1oqp 1
26 1 1 . . . . . . . . . 163 MET HN parsed_1oqp 1
26 1 2 . . . . . . . . . 159 PHE O parsed_1oqp 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 . . . . . . . 2.30 parsed_1oqp 1
2 1 . . . . . . . 2.30 parsed_1oqp 1
3 1 . . . . . . . 2.30 parsed_1oqp 1
4 1 . . . . . . . 2.30 parsed_1oqp 1
5 1 . . . . . . . 2.30 parsed_1oqp 1
6 1 . . . . . . . 2.30 parsed_1oqp 1
7 1 . . . . . . . 2.30 parsed_1oqp 1
8 1 . . . . . . . 2.30 parsed_1oqp 1
9 1 . . . . . . . 2.30 parsed_1oqp 1
10 1 . . . . . . . 2.30 parsed_1oqp 1
11 1 . . . . . . . 2.30 parsed_1oqp 1
12 1 . . . . . . . 2.30 parsed_1oqp 1
13 1 . . . . . . . 2.30 parsed_1oqp 1
14 1 . . . . . . . 2.30 parsed_1oqp 1
15 1 . . . . . . . 2.30 parsed_1oqp 1
16 1 . . . . . . . 2.30 parsed_1oqp 1
17 1 . . . . . . . 2.30 parsed_1oqp 1
18 1 . . . . . . . 2.30 parsed_1oqp 1
19 1 . . . . . . . 2.30 parsed_1oqp 1
20 1 . . . . . . . 2.30 parsed_1oqp 1
21 1 . . . . . . . 2.30 parsed_1oqp 1
22 1 . . . . . . . 2.30 parsed_1oqp 1
23 1 . . . . . . . 2.30 parsed_1oqp 1
24 1 . . . . . . . 2.30 parsed_1oqp 1
25 1 . . . . . . . 2.30 parsed_1oqp 1
26 1 . . . . . . . 2.30 parsed_1oqp 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 "52 distance restraints for 26 H-bonds" 1 1 1 39 parsed_1oqp 1
2 "hydrogen bonds upper bound file" 2 1 2 33 parsed_1oqp 1
stop_
save_
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