NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype | item_count |
|
|
38876 |
1s9s   |
cing | 2-parsed | STAR | distance | general distance | simple | 24 |
data_1s9s_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1s9s
_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_1s9s 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1s9s
_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 1s9s "Master copy" parsed_1s9s
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1s9s
_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 1s9s.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 3 sequence "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 5 distance "general distance" simple 30 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 6 distance "hydrogen bond" simple 60 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 7 distance NOE simple 292 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 8 distance "general distance" simple 43 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 9 distance "hydrogen bond" simple 97 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 10 distance NOE simple 383 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 11 distance "general distance" simple 8 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 12 distance "general distance" simple 24 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 13 distance "hydrogen bond" simple 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 14 distance NOE simple 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 15 distance "general distance" simple 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 16 distance NOE simple 0 parsed_1s9s 1
1 1s9s.mr . . n/a 17 comment "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 18 distance "hydrogen bond" simple 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 19 distance "general distance" simple 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 20 distance "hydrogen bond" simple 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 21 distance "general distance" simple 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 22 distance "hydrogen bond" simple 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 23 distance "general distance" simple 0 parsed_1s9s 1
1 1s9s.mr . . n/a 24 comment "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 25 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . n/a 26 comment "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . DYANA/DIANA 27 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1s9s 1
1 1s9s.mr . . "MR format" 28 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1s9s 1
stop_
save_
save_DYANA/DIANA_distance_constraints_12
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_1s9s
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 12
_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_1s9s 1
2 1 . . . parsed_1s9s 1
3 1 . . . parsed_1s9s 1
4 1 . . . parsed_1s9s 1
5 1 . . . parsed_1s9s 1
6 1 . . . parsed_1s9s 1
7 1 . . . parsed_1s9s 1
8 1 . . . parsed_1s9s 1
9 1 . . . parsed_1s9s 1
10 1 . . . parsed_1s9s 1
11 1 . . . parsed_1s9s 1
12 1 . . . parsed_1s9s 1
13 1 . . . parsed_1s9s 1
14 1 . . . parsed_1s9s 1
15 1 . . . parsed_1s9s 1
16 1 . . . parsed_1s9s 1
17 1 . . . parsed_1s9s 1
18 1 . . . parsed_1s9s 1
19 1 . . . parsed_1s9s 1
20 1 . . . parsed_1s9s 1
21 1 . . . parsed_1s9s 1
22 1 . . . parsed_1s9s 1
23 1 . . . parsed_1s9s 1
24 1 . . . parsed_1s9s 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 . . . . . . . . . 353 RADE C4' parsed_1s9s 1
1 1 2 . . . . . . . . . 353 RADE O4' parsed_1s9s 1
2 1 1 . . . . . . . . . 354 RADE C4' parsed_1s9s 1
2 1 2 . . . . . . . . . 354 RADE O4' parsed_1s9s 1
3 1 1 . . . . . . . . . 355 RCYT C4' parsed_1s9s 1
3 1 2 . . . . . . . . . 355 RCYT O4' parsed_1s9s 1
4 1 1 . . . . . . . . . 356 RCYT C4' parsed_1s9s 1
4 1 2 . . . . . . . . . 356 RCYT O4' parsed_1s9s 1
5 1 1 . . . . . . . . . 357 RCYT C4' parsed_1s9s 1
5 1 2 . . . . . . . . . 357 RCYT O4' parsed_1s9s 1
6 1 1 . . . . . . . . . 358 URA C4' parsed_1s9s 1
6 1 2 . . . . . . . . . 358 URA O4' parsed_1s9s 1
7 1 1 . . . . . . . . . 359 RGUA C4' parsed_1s9s 1
7 1 2 . . . . . . . . . 359 RGUA O4' parsed_1s9s 1
8 1 1 . . . . . . . . . 360 RGUA C4' parsed_1s9s 1
8 1 2 . . . . . . . . . 360 RGUA O4' parsed_1s9s 1
9 1 1 . . . . . . . . . 361 RGUA C4' parsed_1s9s 1
9 1 2 . . . . . . . . . 361 RGUA O4' parsed_1s9s 1
10 1 1 . . . . . . . . . 362 RADE C4' parsed_1s9s 1
10 1 2 . . . . . . . . . 362 RADE O4' parsed_1s9s 1
11 1 1 . . . . . . . . . 363 RGUA C4' parsed_1s9s 1
11 1 2 . . . . . . . . . 363 RGUA O4' parsed_1s9s 1
12 1 1 . . . . . . . . . 364 RADE C4' parsed_1s9s 1
12 1 2 . . . . . . . . . 364 RADE O4' parsed_1s9s 1
13 1 1 . . . . . . . . . 365 RGUA C4' parsed_1s9s 1
13 1 2 . . . . . . . . . 365 RGUA O4' parsed_1s9s 1
14 1 1 . . . . . . . . . 366 RGUA C4' parsed_1s9s 1
14 1 2 . . . . . . . . . 366 RGUA O4' parsed_1s9s 1
15 1 1 . . . . . . . . . 367 URA C4' parsed_1s9s 1
15 1 2 . . . . . . . . . 367 URA O4' parsed_1s9s 1
16 1 1 . . . . . . . . . 368 RCYT C4' parsed_1s9s 1
16 1 2 . . . . . . . . . 368 RCYT O4' parsed_1s9s 1
17 1 1 . . . . . . . . . 369 RCYT C4' parsed_1s9s 1
17 1 2 . . . . . . . . . 369 RCYT O4' parsed_1s9s 1
18 1 1 . . . . . . . . . 370 RCYT C4' parsed_1s9s 1
18 1 2 . . . . . . . . . 370 RCYT O4' parsed_1s9s 1
19 1 1 . . . . . . . . . 371 RADE C4' parsed_1s9s 1
19 1 2 . . . . . . . . . 371 RADE O4' parsed_1s9s 1
20 1 1 . . . . . . . . . 372 RGUA C4' parsed_1s9s 1
20 1 2 . . . . . . . . . 372 RGUA O4' parsed_1s9s 1
21 1 1 . . . . . . . . . 373 RGUA C4' parsed_1s9s 1
21 1 2 . . . . . . . . . 373 RGUA O4' parsed_1s9s 1
22 1 1 . . . . . . . . . 374 RGUA C4' parsed_1s9s 1
22 1 2 . . . . . . . . . 374 RGUA O4' parsed_1s9s 1
23 1 1 . . . . . . . . . 375 URA C4' parsed_1s9s 1
23 1 2 . . . . . . . . . 375 URA O4' parsed_1s9s 1
24 1 1 . . . . . . . . . 376 URA C4' parsed_1s9s 1
24 1 2 . . . . . . . . . 376 URA O4' parsed_1s9s 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 . . . . . . . 1.40 parsed_1s9s 1
2 1 . . . . . . . 1.40 parsed_1s9s 1
3 1 . . . . . . . 1.40 parsed_1s9s 1
4 1 . . . . . . . 1.40 parsed_1s9s 1
5 1 . . . . . . . 1.40 parsed_1s9s 1
6 1 . . . . . . . 1.40 parsed_1s9s 1
7 1 . . . . . . . 1.40 parsed_1s9s 1
8 1 . . . . . . . 1.40 parsed_1s9s 1
9 1 . . . . . . . 1.40 parsed_1s9s 1
10 1 . . . . . . . 1.40 parsed_1s9s 1
11 1 . . . . . . . 1.40 parsed_1s9s 1
12 1 . . . . . . . 1.40 parsed_1s9s 1
13 1 . . . . . . . 1.40 parsed_1s9s 1
14 1 . . . . . . . 1.40 parsed_1s9s 1
15 1 . . . . . . . 1.40 parsed_1s9s 1
16 1 . . . . . . . 1.40 parsed_1s9s 1
17 1 . . . . . . . 1.40 parsed_1s9s 1
18 1 . . . . . . . 1.40 parsed_1s9s 1
19 1 . . . . . . . 1.40 parsed_1s9s 1
20 1 . . . . . . . 1.40 parsed_1s9s 1
21 1 . . . . . . . 1.40 parsed_1s9s 1
22 1 . . . . . . . 1.40 parsed_1s9s 1
23 1 . . . . . . . 1.40 parsed_1s9s 1
24 1 . . . . . . . 1.40 parsed_1s9s 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 "----------------------BEGIN C4'-O4' BOND----------------------------" 2 1 2 69 parsed_1s9s 1
2 "C4'-O4' bond is not in the DYANA residue library -this is a cov. bond" 3 1 3 71 parsed_1s9s 1
3 "----------------------END C4'-O4' BOND------------------------------" 30 1 30 69 parsed_1s9s 1
stop_
save_
Contact the webmaster for help, if required. Monday, April 29, 2024 4:16:56 PM GMT (wattos1)