NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
34418 |
1jvr   |
cing | 2-parsed | STAR | distance | hydrogen bond | simple | 11 |
data_1jvr_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1jvr
_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_1jvr 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1jvr
_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 1jvr "Master copy" parsed_1jvr
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1jvr
_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 1jvr.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1jvr 1
1 1jvr.mr . . DYANA/DIANA 2 distance "hydrogen bond" simple 11 parsed_1jvr 1
1 1jvr.mr . . DYANA/DIANA 3 distance NOE simple 0 parsed_1jvr 1
1 1jvr.mr . . DYANA/DIANA 4 distance "hydrogen bond" simple 0 parsed_1jvr 1
1 1jvr.mr . . DYANA/DIANA 5 distance NOE simple 0 parsed_1jvr 1
1 1jvr.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1jvr 1
stop_
save_
save_DYANA/DIANA_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1jvr
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "hydrogen bond"
_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_1jvr 1
2 1 . . . parsed_1jvr 1
3 1 . . . parsed_1jvr 1
4 1 . . . parsed_1jvr 1
5 1 . . . parsed_1jvr 1
6 1 . . . parsed_1jvr 1
7 1 . . . parsed_1jvr 1
8 1 . . . parsed_1jvr 1
9 1 . . . parsed_1jvr 1
10 1 . . . parsed_1jvr 1
11 1 . . . parsed_1jvr 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 . . . . . . . . . 20 SER O parsed_1jvr 1
1 1 2 . . . . . . . . . 24 TRP HN parsed_1jvr 1
2 1 1 . . . . . . . . . 21 THR O parsed_1jvr 1
2 1 2 . . . . . . . . . 25 LEU HN parsed_1jvr 1
3 1 1 . . . . . . . . . 22 HIS O parsed_1jvr 1
3 1 2 . . . . . . . . . 26 ASN HN parsed_1jvr 1
4 1 1 . . . . . . . . . 23 HIS O parsed_1jvr 1
4 1 2 . . . . . . . . . 27 PHE HN parsed_1jvr 1
5 1 1 . . . . . . . . . 24 TRP O parsed_1jvr 1
5 1 2 . . . . . . . . . 28 LEU HN parsed_1jvr 1
6 1 1 . . . . . . . . . 25 LEU O parsed_1jvr 1
6 1 2 . . . . . . . . . 29 GLN HN parsed_1jvr 1
7 1 1 . . . . . . . . . 26 ASN O parsed_1jvr 1
7 1 2 . . . . . . . . . 30 ALA HN parsed_1jvr 1
8 1 1 . . . . . . . . . 27 PHE O parsed_1jvr 1
8 1 2 . . . . . . . . . 31 ALA HN parsed_1jvr 1
9 1 1 . . . . . . . . . 28 LEU O parsed_1jvr 1
9 1 2 . . . . . . . . . 32 TYR HN parsed_1jvr 1
10 1 1 . . . . . . . . . 29 GLN O parsed_1jvr 1
10 1 2 . . . . . . . . . 33 ARG HN parsed_1jvr 1
11 1 1 . . . . . . . . . 30 ALA O parsed_1jvr 1
11 1 2 . . . . . . . . . 34 LEU HN parsed_1jvr 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 . . . . . . . 2.20 parsed_1jvr 1
2 1 . . . . . . . 2.20 parsed_1jvr 1
3 1 . . . . . . . 2.20 parsed_1jvr 1
4 1 . . . . . . . 2.20 parsed_1jvr 1
5 1 . . . . . . . 2.20 parsed_1jvr 1
6 1 . . . . . . . 2.20 parsed_1jvr 1
7 1 . . . . . . . 2.20 parsed_1jvr 1
8 1 . . . . . . . 2.20 parsed_1jvr 1
9 1 . . . . . . . 2.20 parsed_1jvr 1
10 1 . . . . . . . 2.20 parsed_1jvr 1
11 1 . . . . . . . 2.20 parsed_1jvr 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 --------------------------------------------------------------- 1 1 1 64 parsed_1jvr 1
2 "HELIX I***" 2 1 2 36 parsed_1jvr 1
3 --------------------------------------------------------------- 3 1 3 64 parsed_1jvr 1
4 "HYDROGEN BONDS" 4 1 4 38 parsed_1jvr 1
5 --------------------------------------------------------------- 5 1 5 65 parsed_1jvr 1
6 "20 SER OG 24 TRP HN 2.20 1.00E+00 # N-CAP" 6 1 6 55 parsed_1jvr 1
7 N-CAP 7 48 7 54 parsed_1jvr 1
8 N-CAP 8 48 8 54 parsed_1jvr 1
9 N-CAP 9 48 9 55 parsed_1jvr 1
10 h-bonds 10 48 10 56 parsed_1jvr 1
11 h-bonds 11 48 11 56 parsed_1jvr 1
12 h-bonds 12 48 12 56 parsed_1jvr 1
13 h-bonds 13 48 13 56 parsed_1jvr 1
14 h-bonds 14 48 14 56 parsed_1jvr 1
15 h-bonds 15 48 15 56 parsed_1jvr 1
16 h-bonds 16 48 16 56 parsed_1jvr 1
17 h-bonds 17 48 17 56 parsed_1jvr 1
stop_
save_
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