NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
543612 |
2lup   |
18534 | cing | 2-parsed | STAR | dipolar coupling | 81 |
data_2lup_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lup
_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_2lup 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lup
_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 2lup "Master copy" parsed_2lup
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lup
_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 2lup.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lup 1
1 2lup.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 227 parsed_2lup 1
1 2lup.mr . . XPLOR/CNS 3 distance NOE simple 2324 parsed_2lup 1
1 2lup.mr . . XPLOR/CNS 4 distance NOE ambi 36 parsed_2lup 1
1 2lup.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 81 parsed_2lup 1
1 2lup.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lup 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2lup
_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 . . . . . . . . . . . . . . . . -2.920 -3.920 -1.920 . . . 366 . N . 366 . HN parsed_2lup 1
2 . . . . . . . . . . . . . . . . 0.610 -0.390 1.610 . . . 367 . N . 367 . HN parsed_2lup 1
3 . . . . . . . . . . . . . . . . 3.170 2.170 4.170 . . . 368 . N . 368 . HN parsed_2lup 1
4 . . . . . . . . . . . . . . . . 1.410 0.410 2.410 . . . 369 . N . 369 . HN parsed_2lup 1
5 . . . . . . . . . . . . . . . . -18.110 -19.110 -17.110 . . . 370 . N . 370 . HN parsed_2lup 1
6 . . . . . . . . . . . . . . . . -22.550 -23.550 -21.550 . . . 371 . N . 371 . HN parsed_2lup 1
7 . . . . . . . . . . . . . . . . -20.450 -21.450 -19.450 . . . 373 . N . 373 . HN parsed_2lup 1
8 . . . . . . . . . . . . . . . . -8.460 -9.460 -7.460 . . . 374 . N . 374 . HN parsed_2lup 1
9 . . . . . . . . . . . . . . . . -2.670 -3.670 -1.670 . . . 375 . N . 375 . HN parsed_2lup 1
10 . . . . . . . . . . . . . . . . -9.400 -10.400 -8.400 . . . 376 . N . 376 . HN parsed_2lup 1
11 . . . . . . . . . . . . . . . . -33.850 -34.850 -32.850 . . . 377 . N . 377 . HN parsed_2lup 1
12 . . . . . . . . . . . . . . . . -31.070 -32.070 -30.070 . . . 378 . N . 378 . HN parsed_2lup 1
13 . . . . . . . . . . . . . . . . 14.650 13.650 15.650 . . . 379 . N . 379 . HN parsed_2lup 1
14 . . . . . . . . . . . . . . . . 12.610 11.610 13.610 . . . 380 . N . 380 . HN parsed_2lup 1
15 . . . . . . . . . . . . . . . . -5.490 -6.490 -4.490 . . . 382 . N . 382 . HN parsed_2lup 1
16 . . . . . . . . . . . . . . . . 21.750 20.750 22.750 . . . 383 . N . 383 . HN parsed_2lup 1
17 . . . . . . . . . . . . . . . . 6.830 5.830 7.830 . . . 384 . N . 384 . HN parsed_2lup 1
18 . . . . . . . . . . . . . . . . 4.150 3.150 5.150 . . . 385 . N . 385 . HN parsed_2lup 1
19 . . . . . . . . . . . . . . . . 10.500 9.500 11.500 . . . 386 . N . 386 . HN parsed_2lup 1
20 . . . . . . . . . . . . . . . . 2.940 1.940 3.940 . . . 387 . N . 387 . HN parsed_2lup 1
21 . . . . . . . . . . . . . . . . -5.700 -6.700 -4.700 . . . 388 . N . 388 . HN parsed_2lup 1
22 . . . . . . . . . . . . . . . . 6.090 5.090 7.090 . . . 389 . N . 389 . HN parsed_2lup 1
23 . . . . . . . . . . . . . . . . 14.840 13.840 15.840 . . . 390 . N . 390 . HN parsed_2lup 1
24 . . . . . . . . . . . . . . . . 22.490 21.490 23.490 . . . 392 . N . 392 . HN parsed_2lup 1
25 . . . . . . . . . . . . . . . . 3.830 2.830 4.830 . . . 394 . N . 394 . HN parsed_2lup 1
26 . . . . . . . . . . . . . . . . 11.420 10.420 12.420 . . . 395 . N . 395 . HN parsed_2lup 1
27 . . . . . . . . . . . . . . . . 9.330 8.330 10.330 . . . 396 . N . 396 . HN parsed_2lup 1
28 . . . . . . . . . . . . . . . . 8.150 7.150 9.150 . . . 397 . N . 397 . HN parsed_2lup 1
29 . . . . . . . . . . . . . . . . 16.090 15.090 17.090 . . . 399 . N . 399 . HN parsed_2lup 1
30 . . . . . . . . . . . . . . . . 22.370 21.370 23.370 . . . 400 . N . 400 . HN parsed_2lup 1
31 . . . . . . . . . . . . . . . . 7.470 6.470 8.470 . . . 401 . N . 401 . HN parsed_2lup 1
32 . . . . . . . . . . . . . . . . 16.860 15.860 17.860 . . . 402 . N . 402 . HN parsed_2lup 1
33 . . . . . . . . . . . . . . . . -1.130 -2.130 -0.130 . . . 403 . N . 403 . HN parsed_2lup 1
34 . . . . . . . . . . . . . . . . 0.530 -0.470 1.530 . . . 404 . N . 404 . HN parsed_2lup 1
35 . . . . . . . . . . . . . . . . -11.460 -12.460 -10.460 . . . 405 . N . 405 . HN parsed_2lup 1
36 . . . . . . . . . . . . . . . . 8.140 7.140 9.140 . . . 406 . N . 406 . HN parsed_2lup 1
37 . . . . . . . . . . . . . . . . 16.290 15.290 17.290 . . . 407 . N . 407 . HN parsed_2lup 1
38 . . . . . . . . . . . . . . . . 13.840 12.840 14.840 . . . 409 . N . 409 . HN parsed_2lup 1
39 . . . . . . . . . . . . . . . . -9.350 -10.350 -8.350 . . . 410 . N . 410 . HN parsed_2lup 1
40 . . . . . . . . . . . . . . . . 8.770 7.770 9.770 . . . 411 . N . 411 . HN parsed_2lup 1
41 . . . . . . . . . . . . . . . . -7.200 -8.200 -6.200 . . . 412 . N . 412 . HN parsed_2lup 1
42 . . . . . . . . . . . . . . . . 9.970 8.970 10.970 . . . 413 . N . 413 . HN parsed_2lup 1
43 . . . . . . . . . . . . . . . . 9.89 8.89 10.89 . . . 414 . N . 414 . HN parsed_2lup 1
44 . . . . . . . . . . . . . . . . 14.070 13.070 15.070 . . . 415 . N . 415 . HN parsed_2lup 1
45 . . . . . . . . . . . . . . . . 3.470 2.470 4.470 . . . 416 . N . 416 . HN parsed_2lup 1
46 . . . . . . . . . . . . . . . . 13.610 12.610 14.610 . . . 417 . N . 417 . HN parsed_2lup 1
47 . . . . . . . . . . . . . . . . 17.550 16.550 18.550 . . . 418 . N . 418 . HN parsed_2lup 1
48 . . . . . . . . . . . . . . . . -30.300 -31.300 -29.300 . . . 419 . N . 419 . HN parsed_2lup 1
49 . . . . . . . . . . . . . . . . -20.180 -21.180 -19.180 . . . 420 . N . 420 . HN parsed_2lup 1
50 . . . . . . . . . . . . . . . . -30.600 -31.600 -29.600 . . . 421 . N . 421 . HN parsed_2lup 1
51 . . . . . . . . . . . . . . . . -26.310 -27.310 -25.310 . . . 422 . N . 422 . HN parsed_2lup 1
52 . . . . . . . . . . . . . . . . -26.390 -27.390 -25.390 . . . 423 . N . 423 . HN parsed_2lup 1
53 . . . . . . . . . . . . . . . . -27.130 -28.130 -26.130 . . . 424 . N . 424 . HN parsed_2lup 1
54 . . . . . . . . . . . . . . . . -36.080 -37.080 -35.080 . . . 425 . N . 425 . HN parsed_2lup 1
55 . . . . . . . . . . . . . . . . -28.750 -29.750 -27.750 . . . 426 . N . 426 . HN parsed_2lup 1
56 . . . . . . . . . . . . . . . . -15.910 -16.910 -14.910 . . . 427 . N . 427 . HN parsed_2lup 1
57 . . . . . . . . . . . . . . . . -20.590 -21.590 -19.590 . . . 428 . N . 428 . HN parsed_2lup 1
58 . . . . . . . . . . . . . . . . -37.020 -38.020 -36.020 . . . 429 . N . 429 . HN parsed_2lup 1
59 . . . . . . . . . . . . . . . . -28.120 -29.120 -27.120 . . . 430 . N . 430 . HN parsed_2lup 1
60 . . . . . . . . . . . . . . . . -14.430 -15.430 -13.430 . . . 431 . N . 431 . HN parsed_2lup 1
61 . . . . . . . . . . . . . . . . -31.790 -32.790 -30.790 . . . 432 . N . 432 . HN parsed_2lup 1
62 . . . . . . . . . . . . . . . . -11.350 -12.350 -10.350 . . . 433 . N . 433 . HN parsed_2lup 1
63 . . . . . . . . . . . . . . . . -7.480 -8.480 -6.480 . . . 434 . N . 434 . HN parsed_2lup 1
64 . . . . . . . . . . . . . . . . 13.540 12.540 14.540 . . . 435 . N . 435 . HN parsed_2lup 1
65 . . . . . . . . . . . . . . . . -5.050 -6.050 -4.050 . . . 436 . N . 436 . HN parsed_2lup 1
66 . . . . . . . . . . . . . . . . -2.010 -3.010 -1.010 . . . 437 . N . 437 . HN parsed_2lup 1
67 . . . . . . . . . . . . . . . . 8.060 7.060 9.060 . . . 438 . N . 438 . HN parsed_2lup 1
68 . . . . . . . . . . . . . . . . 5.140 4.140 6.140 . . . 439 . N . 439 . HN parsed_2lup 1
69 . . . . . . . . . . . . . . . . -10.280 -11.280 -9.280 . . . 440 . N . 440 . HN parsed_2lup 1
70 . . . . . . . . . . . . . . . . 1.690 0.690 2.690 . . . 441 . N . 441 . HN parsed_2lup 1
71 . . . . . . . . . . . . . . . . 6.980 5.980 7.980 . . . 442 . N . 442 . HN parsed_2lup 1
72 . . . . . . . . . . . . . . . . 1.460 0.460 2.460 . . . 443 . N . 443 . HN parsed_2lup 1
73 . . . . . . . . . . . . . . . . -10.490 -11.490 -9.490 . . . 444 . N . 444 . HN parsed_2lup 1
74 . . . . . . . . . . . . . . . . 5.680 4.680 6.680 . . . 445 . N . 445 . HN parsed_2lup 1
75 . . . . . . . . . . . . . . . . 3.460 2.460 4.460 . . . 446 . N . 446 . HN parsed_2lup 1
76 . . . . . . . . . . . . . . . . -8.950 -9.950 -7.950 . . . 447 . N . 447 . HN parsed_2lup 1
77 . . . . . . . . . . . . . . . . -2.840 -3.840 -1.840 . . . 448 . N . 448 . HN parsed_2lup 1
78 . . . . . . . . . . . . . . . . -9.590 -10.590 -8.590 . . . 450 . N . 450 . HN parsed_2lup 1
79 . . . . . . . . . . . . . . . . -4.460 -5.460 -3.460 . . . 451 . N . 451 . HN parsed_2lup 1
80 . . . . . . . . . . . . . . . . -0.400 -1.400 0.600 . . . 452 . N . 452 . HN parsed_2lup 1
81 . . . . . . . . . . . . . . . . 0.950 -0.050 1.950 . . . 453 . N . 453 . HN parsed_2lup 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 "* H-N one-bond residual dipolar couplings of rnt1p dsRBD in complex *" 1 1 1 1 parsed_2lup 1
stop_
save_
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