NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
520213 |
2lbs   |
17574 | cing | 2-parsed | STAR | dipolar coupling | 83 |
data_2lbs_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lbs
_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_2lbs 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lbs
_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 2lbs "Master copy" parsed_2lbs
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lbs
_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 2lbs.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lbs 1
1 2lbs.mr . . XPLOR/CNS 2 distance NOE simple 2743 parsed_2lbs 1
1 2lbs.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 83 parsed_2lbs 1
1 2lbs.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2lbs 1
1 2lbs.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2lbs 1
1 2lbs.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lbs 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2lbs
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . -1.7 -2.70 -0.70 . . . 366 . N . 366 . HN parsed_2lbs 1
2 . . . . . . . . . . . . . . . . 4.44 3.44 5.44 . . . 367 . N . 367 . HN parsed_2lbs 1
3 . . . . . . . . . . . . . . . . 3.17 2.17 4.17 . . . 368 . N . 368 . HN parsed_2lbs 1
4 . . . . . . . . . . . . . . . . 2.93 1.93 3.93 . . . 369 . N . 369 . HN parsed_2lbs 1
5 . . . . . . . . . . . . . . . . -12.47 -13.47 -11.47 . . . 370 . N . 370 . HN parsed_2lbs 1
6 . . . . . . . . . . . . . . . . -14.18 -15.18 -13.18 . . . 371 . N . 371 . HN parsed_2lbs 1
7 . . . . . . . . . . . . . . . . -13.07 -14.07 -12.07 . . . 373 . N . 373 . HN parsed_2lbs 1
8 . . . . . . . . . . . . . . . . -2.79 -3.79 -1.79 . . . 374 . N . 374 . HN parsed_2lbs 1
9 . . . . . . . . . . . . . . . . 3.29 2.29 4.29 . . . 375 . N . 375 . HN parsed_2lbs 1
10 . . . . . . . . . . . . . . . . -12.55 -13.55 -11.55 . . . 376 . N . 376 . HN parsed_2lbs 1
11 . . . . . . . . . . . . . . . . -19.77 -20.77 -18.77 . . . 377 . N . 377 . HN parsed_2lbs 1
12 . . . . . . . . . . . . . . . . -20.75 -21.75 -19.75 . . . 378 . N . 378 . HN parsed_2lbs 1
13 . . . . . . . . . . . . . . . . 9.42 8.42 10.42 . . . 379 . N . 379 . HN parsed_2lbs 1
14 . . . . . . . . . . . . . . . . 7.59 6.59 8.59 . . . 380 . N . 380 . HN parsed_2lbs 1
15 . . . . . . . . . . . . . . . . -4.79 -5.79 -3.79 . . . 382 . N . 382 . HN parsed_2lbs 1
16 . . . . . . . . . . . . . . . . 14.46 13.46 15.46 . . . 383 . N . 383 . HN parsed_2lbs 1
17 . . . . . . . . . . . . . . . . 6.49 5.49 7.49 . . . 384 . N . 384 . HN parsed_2lbs 1
18 . . . . . . . . . . . . . . . . 7.72 6.72 8.72 . . . 385 . N . 385 . HN parsed_2lbs 1
19 . . . . . . . . . . . . . . . . 7.16 6.16 8.16 . . . 386 . N . 386 . HN parsed_2lbs 1
20 . . . . . . . . . . . . . . . . 5.61 4.61 6.61 . . . 387 . N . 387 . HN parsed_2lbs 1
21 . . . . . . . . . . . . . . . . -5.45 -6.45 -4.45 . . . 388 . N . 388 . HN parsed_2lbs 1
22 . . . . . . . . . . . . . . . . 5.17 4.17 6.17 . . . 389 . N . 389 . HN parsed_2lbs 1
23 . . . . . . . . . . . . . . . . 11.36 10.36 12.36 . . . 390 . N . 390 . HN parsed_2lbs 1
24 . . . . . . . . . . . . . . . . 15.87 14.87 16.87 . . . 391 . N . 391 . HN parsed_2lbs 1
25 . . . . . . . . . . . . . . . . 14.96 13.96 15.96 . . . 392 . N . 392 . HN parsed_2lbs 1
26 . . . . . . . . . . . . . . . . 5.03 4.03 6.03 . . . 394 . N . 394 . HN parsed_2lbs 1
27 . . . . . . . . . . . . . . . . 9.84 8.84 10.84 . . . 395 . N . 395 . HN parsed_2lbs 1
28 . . . . . . . . . . . . . . . . 7.36 6.36 8.36 . . . 396 . N . 396 . HN parsed_2lbs 1
29 . . . . . . . . . . . . . . . . 7.88 6.88 8.88 . . . 397 . N . 397 . HN parsed_2lbs 1
30 . . . . . . . . . . . . . . . . 10.9 9.90 11.90 . . . 399 . N . 399 . HN parsed_2lbs 1
31 . . . . . . . . . . . . . . . . 15.7 14.70 16.70 . . . 400 . N . 400 . HN parsed_2lbs 1
32 . . . . . . . . . . . . . . . . 5.85 4.85 6.85 . . . 401 . N . 401 . HN parsed_2lbs 1
33 . . . . . . . . . . . . . . . . 13.99 12.99 14.99 . . . 402 . N . 402 . HN parsed_2lbs 1
34 . . . . . . . . . . . . . . . . 1.47 0.47 2.47 . . . 403 . N . 403 . HN parsed_2lbs 1
35 . . . . . . . . . . . . . . . . 2.46 1.46 3.46 . . . 404 . N . 404 . HN parsed_2lbs 1
36 . . . . . . . . . . . . . . . . -2.99 -3.99 -1.99 . . . 405 . N . 405 . HN parsed_2lbs 1
37 . . . . . . . . . . . . . . . . 8.86 7.86 9.86 . . . 406 . N . 406 . HN parsed_2lbs 1
38 . . . . . . . . . . . . . . . . 10.46 9.46 11.46 . . . 407 . N . 407 . HN parsed_2lbs 1
39 . . . . . . . . . . . . . . . . 5.22 4.22 6.22 . . . 408 . N . 408 . HN parsed_2lbs 1
40 . . . . . . . . . . . . . . . . 10.46 9.46 11.46 . . . 409 . N . 409 . HN parsed_2lbs 1
41 . . . . . . . . . . . . . . . . -7.84 -8.84 -6.84 . . . 410 . N . 410 . HN parsed_2lbs 1
42 . . . . . . . . . . . . . . . . 10.15 9.15 11.15 . . . 411 . N . 411 . HN parsed_2lbs 1
43 . . . . . . . . . . . . . . . . -3.17 -4.17 -2.17 . . . 412 . N . 412 . HN parsed_2lbs 1
44 . . . . . . . . . . . . . . . . 8.24 7.24 9.24 . . . 413 . N . 413 . HN parsed_2lbs 1
45 . . . . . . . . . . . . . . . . 4.65 3.65 5.65 . . . 414 . N . 414 . HN parsed_2lbs 1
46 . . . . . . . . . . . . . . . . 9.9 8.90 10.90 . . . 415 . N . 415 . HN parsed_2lbs 1
47 . . . . . . . . . . . . . . . . 3.78 2.78 4.78 . . . 416 . N . 416 . HN parsed_2lbs 1
48 . . . . . . . . . . . . . . . . 12.29 11.29 13.29 . . . 417 . N . 417 . HN parsed_2lbs 1
49 . . . . . . . . . . . . . . . . 13.05 12.05 14.05 . . . 418 . N . 418 . HN parsed_2lbs 1
50 . . . . . . . . . . . . . . . . -16.3 -17.30 -15.30 . . . 419 . N . 419 . HN parsed_2lbs 1
51 . . . . . . . . . . . . . . . . -10.05 -11.05 -9.05 . . . 420 . N . 420 . HN parsed_2lbs 1
52 . . . . . . . . . . . . . . . . -22.87 -23.87 -21.87 . . . 421 . N . 421 . HN parsed_2lbs 1
53 . . . . . . . . . . . . . . . . -18.05 -19.05 -17.05 . . . 422 . N . 422 . HN parsed_2lbs 1
54 . . . . . . . . . . . . . . . . -19.28 -20.28 -18.28 . . . 423 . N . 423 . HN parsed_2lbs 1
55 . . . . . . . . . . . . . . . . -19.71 -20.71 -18.71 . . . 424 . N . 424 . HN parsed_2lbs 1
56 . . . . . . . . . . . . . . . . -25.11 -26.11 -24.11 . . . 425 . N . 425 . HN parsed_2lbs 1
57 . . . . . . . . . . . . . . . . -21.22 -22.22 -20.22 . . . 426 . N . 426 . HN parsed_2lbs 1
58 . . . . . . . . . . . . . . . . -12.81 -13.81 -11.81 . . . 427 . N . 427 . HN parsed_2lbs 1
59 . . . . . . . . . . . . . . . . -16.44 -17.44 -15.44 . . . 428 . N . 428 . HN parsed_2lbs 1
60 . . . . . . . . . . . . . . . . -27.24 -28.24 -26.24 . . . 429 . N . 429 . HN parsed_2lbs 1
61 . . . . . . . . . . . . . . . . -19.29 -20.29 -18.29 . . . 430 . N . 430 . HN parsed_2lbs 1
62 . . . . . . . . . . . . . . . . -10.98 -11.98 -9.98 . . . 431 . N . 431 . HN parsed_2lbs 1
63 . . . . . . . . . . . . . . . . -19.58 -20.58 -18.58 . . . 432 . N . 432 . HN parsed_2lbs 1
64 . . . . . . . . . . . . . . . . -9.24 -10.24 -8.24 . . . 433 . N . 433 . HN parsed_2lbs 1
65 . . . . . . . . . . . . . . . . -2.54 -3.54 -1.54 . . . 434 . N . 434 . HN parsed_2lbs 1
66 . . . . . . . . . . . . . . . . 5.48 4.48 6.48 . . . 435 . N . 435 . HN parsed_2lbs 1
67 . . . . . . . . . . . . . . . . -3.83 -4.83 -2.83 . . . 436 . N . 436 . HN parsed_2lbs 1
68 . . . . . . . . . . . . . . . . -5.41 -6.41 -4.41 . . . 437 . N . 437 . HN parsed_2lbs 1
69 . . . . . . . . . . . . . . . . 4.01 3.01 5.01 . . . 438 . N . 438 . HN parsed_2lbs 1
70 . . . . . . . . . . . . . . . . 5.59 4.59 6.59 . . . 439 . N . 439 . HN parsed_2lbs 1
71 . . . . . . . . . . . . . . . . -5.59 -6.59 -4.59 . . . 440 . N . 440 . HN parsed_2lbs 1
72 . . . . . . . . . . . . . . . . 2.26 1.26 3.26 . . . 441 . N . 441 . HN parsed_2lbs 1
73 . . . . . . . . . . . . . . . . 2.75 1.75 3.75 . . . 442 . N . 442 . HN parsed_2lbs 1
74 . . . . . . . . . . . . . . . . 2.73 1.73 3.73 . . . 443 . N . 443 . HN parsed_2lbs 1
75 . . . . . . . . . . . . . . . . -5.77 -6.77 -4.77 . . . 444 . N . 444 . HN parsed_2lbs 1
76 . . . . . . . . . . . . . . . . 3.4 2.40 4.40 . . . 445 . N . 445 . HN parsed_2lbs 1
77 . . . . . . . . . . . . . . . . 4.45 3.45 5.45 . . . 446 . N . 446 . HN parsed_2lbs 1
78 . . . . . . . . . . . . . . . . -8.22 -9.22 -7.22 . . . 447 . N . 447 . HN parsed_2lbs 1
79 . . . . . . . . . . . . . . . . -1.77 -2.77 -0.77 . . . 448 . N . 448 . HN parsed_2lbs 1
80 . . . . . . . . . . . . . . . . -5.68 -6.68 -4.68 . . . 450 . N . 450 . HN parsed_2lbs 1
81 . . . . . . . . . . . . . . . . -6.64 -7.64 -5.64 . . . 451 . N . 451 . HN parsed_2lbs 1
82 . . . . . . . . . . . . . . . . 1.21 0.21 2.21 . . . 452 . N . 452 . HN parsed_2lbs 1
83 . . . . . . . . . . . . . . . . 1.27 0.27 2.27 . . . 453 . N . 453 . HN parsed_2lbs 1
stop_
save_
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