Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
50974 | 2k4i RC | 16889 | cing | 2-parsed | STAR | distance | hydrogen bond | simple | 12 |
data_2k4i_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k4i
_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_2k4i 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k4i
_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 2k4i "Master copy" parsed_2k4i
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k4i
_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 2k4i.mr . . n/a 1 n/a "Not applicable" "Not applicable" 0 parsed_2k4i 1
1 2k4i.mr . . DYANA/DIANA 2 distance NOE simple 839 parsed_2k4i 1
1 2k4i.mr . . DYANA/DIANA 3 distance "hydrogen bond" simple 12 parsed_2k4i 1
1 2k4i.mr . . DYANA/DIANA 4 distance NOE simple 0 parsed_2k4i 1
1 2k4i.mr . . DYANA/DIANA 5 distance "hydrogen bond" simple 0 parsed_2k4i 1
1 2k4i.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k4i 1
stop_
save_
save_DYANA/DIANA_distance_constraints_3
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2k4i
_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_2k4i 1
2 1 . . . parsed_2k4i 1
3 1 . . . parsed_2k4i 1
4 1 . . . parsed_2k4i 1
5 1 . . . parsed_2k4i 1
6 1 . . . parsed_2k4i 1
7 1 . . . parsed_2k4i 1
8 1 . . . parsed_2k4i 1
9 1 . . . parsed_2k4i 1
10 1 . . . parsed_2k4i 1
11 1 . . . parsed_2k4i 1
12 1 . . . parsed_2k4i 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 . . . . . . . . . 21 LEU H parsed_2k4i 1
1 1 2 . . . . . . . . . 27 LYS O parsed_2k4i 1
2 1 1 . . . . . . . . . 21 LEU N parsed_2k4i 1
2 1 2 . . . . . . . . . 27 LYS O parsed_2k4i 1
3 1 1 . . . . . . . . . 29 TYR OH parsed_2k4i 1
3 1 2 . . . . . . . . . 97 THR HG1 parsed_2k4i 1
4 1 1 . . . . . . . . . 29 TYR OH parsed_2k4i 1
4 1 2 . . . . . . . . . 97 THR OG1 parsed_2k4i 1
5 1 1 . . . . . . . . . 30 ARG H parsed_2k4i 1
5 1 2 . . . . . . . . . 33 HISB ND1 parsed_2k4i 1
6 1 1 . . . . . . . . . 30 ARG N parsed_2k4i 1
6 1 2 . . . . . . . . . 33 HISB ND1 parsed_2k4i 1
7 1 1 . . . . . . . . . 56 GLY H parsed_2k4i 1
7 1 2 . . . . . . . . . 53 SER OG parsed_2k4i 1
8 1 1 . . . . . . . . . 56 GLY N parsed_2k4i 1
8 1 2 . . . . . . . . . 53 SER OG parsed_2k4i 1
9 1 1 . . . . . . . . . 92 GLU OE1 parsed_2k4i 1
9 1 2 . . . . . . . . . 107 HISB HE2 parsed_2k4i 1
10 1 1 . . . . . . . . . 92 GLU OE1 parsed_2k4i 1
10 1 2 . . . . . . . . . 107 HISB NE2 parsed_2k4i 1
11 1 1 . . . . . . . . . 99 GLY H parsed_2k4i 1
11 1 2 . . . . . . . . . 96 ASP OD1 parsed_2k4i 1
12 1 1 . . . . . . . . . 99 GLY N parsed_2k4i 1
12 1 2 . . . . . . . . . 96 ASP OD1 parsed_2k4i 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 . . . . . . . 2.0 parsed_2k4i 1
2 1 . . . . . . . 3.0 parsed_2k4i 1
3 1 . . . . . . . 2.0 parsed_2k4i 1
4 1 . . . . . . . 3.0 parsed_2k4i 1
5 1 . . . . . . . 2.0 parsed_2k4i 1
6 1 . . . . . . . 3.0 parsed_2k4i 1
7 1 . . . . . . . 2.0 parsed_2k4i 1
8 1 . . . . . . . 3.0 parsed_2k4i 1
9 1 . . . . . . . 2.0 parsed_2k4i 1
10 1 . . . . . . . 3.0 parsed_2k4i 1
11 1 . . . . . . . 2.0 parsed_2k4i 1
12 1 . . . . . . . 3.0 parsed_2k4i 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 "############## Side Chain H-bonds ###################" 1 1 1 55 parsed_2k4i 1
2 "Helix cap" 12 33 12 42 parsed_2k4i 1
3 "Helix cap" 13 33 13 42 parsed_2k4i 1
4 "89 HISB ND1 12 LYS QZ 2.0 1.00E+00 #Diff" 15 1 15 41 parsed_2k4i 1
5 "89 HISB ND1 12 LYS NZ 3.0 1.00E+00 #diff" 16 1 16 41 parsed_2k4i 1
6 "89 HISB HE2 51 LEU O 2.0 1.00E+00 #Diff" 18 1 18 40 parsed_2k4i 1
7 "89 HISB NE2 51 LEU O 3.0 1.00E+00 #Diff" 19 1 19 40 parsed_2k4i 1
8 "#################################################################################" 27 1 27 83 parsed_2k4i 1
stop_
save_