NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
40756 |
1wcl   |
cing | 2-parsed | STAR | dipolar coupling | 37 |
data_1wcl_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1wcl
_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_1wcl 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1wcl
_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 1wcl "Master copy" parsed_1wcl
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1wcl
_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 1wcl.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1wcl 1
1 1wcl.mr . . XPLOR/CNS 2 distance NOE ambi 882 parsed_1wcl 1
1 1wcl.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 38 parsed_1wcl 1
1 1wcl.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 39 parsed_1wcl 1
1 1wcl.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 37 parsed_1wcl 1
1 1wcl.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1wcl 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_1wcl
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 5
_RDC_constraint_list.Details "Generated by Wattos"
loop_
_RDC_constraint.ID
_RDC_constraint.Assembly_atom_ID_1
_RDC_constraint.Entity_assembly_ID_1
_RDC_constraint.Entity_ID_1
_RDC_constraint.Comp_index_ID_1
_RDC_constraint.Seq_ID_1
_RDC_constraint.Comp_ID_1
_RDC_constraint.Atom_ID_1
_RDC_constraint.Resonance_ID_1
_RDC_constraint.Assembly_atom_ID_2
_RDC_constraint.Entity_assembly_ID_2
_RDC_constraint.Entity_ID_2
_RDC_constraint.Comp_index_ID_2
_RDC_constraint.Seq_ID_2
_RDC_constraint.Comp_ID_2
_RDC_constraint.Atom_ID_2
_RDC_constraint.Resonance_ID_2
_RDC_constraint.RDC_val
_RDC_constraint.RDC_lower_bound
_RDC_constraint.RDC_upper_bound
_RDC_constraint.RDC_val_err
_RDC_constraint.Source_experiment_ID
_RDC_constraint.Auth_asym_ID_1
_RDC_constraint.Auth_seq_ID_1
_RDC_constraint.Auth_comp_ID_1
_RDC_constraint.Auth_atom_ID_1
_RDC_constraint.Auth_asym_ID_2
_RDC_constraint.Auth_seq_ID_2
_RDC_constraint.Auth_comp_ID_2
_RDC_constraint.Auth_atom_ID_2
_RDC_constraint.Entry_ID
_RDC_constraint.RDC_constraint_list_ID
1 . . . . . . . . . . . . . . . . -8.170 . . . . . 353 . N . 353 . HN parsed_1wcl 1
2 . . . . . . . . . . . . . . . . -9.563 . . . . . 354 . N . 354 . HN parsed_1wcl 1
3 . . . . . . . . . . . . . . . . -8.281 . . . . . 356 . N . 356 . HN parsed_1wcl 1
4 . . . . . . . . . . . . . . . . -10.794 . . . . . 360 . N . 360 . HN parsed_1wcl 1
5 . . . . . . . . . . . . . . . . -8.731 . . . . . 362 . N . 362 . HN parsed_1wcl 1
6 . . . . . . . . . . . . . . . . 7.939 . . . . . 364 . N . 364 . HN parsed_1wcl 1
7 . . . . . . . . . . . . . . . . 6.346 . . . . . 365 . N . 365 . HN parsed_1wcl 1
8 . . . . . . . . . . . . . . . . -10.436 . . . . . 367 . N . 367 . HN parsed_1wcl 1
9 . . . . . . . . . . . . . . . . -11.557 . . . . . 368 . N . 368 . HN parsed_1wcl 1
10 . . . . . . . . . . . . . . . . -7.970 . . . . . 369 . N . 369 . HN parsed_1wcl 1
11 . . . . . . . . . . . . . . . . -11.497 . . . . . 370 . N . 370 . HN parsed_1wcl 1
12 . . . . . . . . . . . . . . . . -9.790 . . . . . 371 . N . 271 . HN parsed_1wcl 1
13 . . . . . . . . . . . . . . . . -11.368 . . . . . 372 . N . 372 . HN parsed_1wcl 1
14 . . . . . . . . . . . . . . . . -10.383 . . . . . 373 . N . 373 . HN parsed_1wcl 1
15 . . . . . . . . . . . . . . . . -10.056 . . . . . 374 . N . 374 . HN parsed_1wcl 1
16 . . . . . . . . . . . . . . . . -10.689 . . . . . 375 . N . 375 . HN parsed_1wcl 1
17 . . . . . . . . . . . . . . . . -12.339 . . . . . 376 . N . 376 . HN parsed_1wcl 1
18 . . . . . . . . . . . . . . . . 6.307 . . . . . 378 . N . 378 . HN parsed_1wcl 1
19 . . . . . . . . . . . . . . . . -10.795 . . . . . 379 . N . 379 . HN parsed_1wcl 1
20 . . . . . . . . . . . . . . . . 2.622 . . . . . 380 . N . 380 . HN parsed_1wcl 1
21 . . . . . . . . . . . . . . . . 8.894 . . . . . 381 . N . 381 . HN parsed_1wcl 1
22 . . . . . . . . . . . . . . . . 0.393 . . . . . 382 . N . 382 . HN parsed_1wcl 1
23 . . . . . . . . . . . . . . . . 2.473 . . . . . 384 . N . 384 . HN parsed_1wcl 1
24 . . . . . . . . . . . . . . . . -2.378 . . . . . 389 . N . 389 . HN parsed_1wcl 1
25 . . . . . . . . . . . . . . . . -4.107 . . . . . 390 . N . 390 . HN parsed_1wcl 1
26 . . . . . . . . . . . . . . . . -3.077 . . . . . 392 . N . 392 . HN parsed_1wcl 1
27 . . . . . . . . . . . . . . . . 14.566 . . . . . 394 . N . 394 . HN parsed_1wcl 1
28 . . . . . . . . . . . . . . . . 6.011 . . . . . 395 . N . 395 . HN parsed_1wcl 1
29 . . . . . . . . . . . . . . . . -9.811 . . . . . 396 . N . 396 . HN parsed_1wcl 1
30 . . . . . . . . . . . . . . . . -8.386 . . . . . 398 . N . 398 . HN parsed_1wcl 1
31 . . . . . . . . . . . . . . . . 17.234 . . . . . 400 . N . 400 . HN parsed_1wcl 1
32 . . . . . . . . . . . . . . . . 16.408 . . . . . 403 . N . 403 . HN parsed_1wcl 1
33 . . . . . . . . . . . . . . . . 17.542 . . . . . 404 . N . 404 . HN parsed_1wcl 1
34 . . . . . . . . . . . . . . . . 18.638 . . . . . 408 . N . 408 . HN parsed_1wcl 1
35 . . . . . . . . . . . . . . . . 18.976 . . . . . 410 . N . 410 . HN parsed_1wcl 1
36 . . . . . . . . . . . . . . . . 14.108 . . . . . 414 . N . 414 . HN parsed_1wcl 1
37 . . . . . . . . . . . . . . . . 16.362 . . . . . 415 . N . 415 . HN parsed_1wcl 1
stop_
loop_
_RDC_constraint_comment_org.ID
_RDC_constraint_comment_org.Comment_text
_RDC_constraint_comment_org.Comment_begin_line
_RDC_constraint_comment_org.Comment_begin_column
_RDC_constraint_comment_org.Comment_end_line
_RDC_constraint_comment_org.Comment_end_column
_RDC_constraint_comment_org.Entry_ID
_RDC_constraint_comment_org.RDC_constraint_list_ID
1
;
RDCS
Measurement of residual dipolar couplings
with 10mg/ml Pf1 phages at 800 MHz; for XPLOR
tensor components of 10.5 (axial comp.) and 0.2 (rhombicity)
were used
;
2 1 6 12 parsed_1wcl 1
stop_
save_
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