NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
551451 |
4a24   |
18004 | cing | 2-parsed | STAR | dihedral angle | 62 |
data_4a24_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_4a24
_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_4a24 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_4a24
_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 4a24 "Master copy" parsed_4a24
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_4a24
_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 4a24.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_4a24 1
1 4a24.mr . . XPLOR/CNS 2 distance NOE simple 802 parsed_4a24 1
1 4a24.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 62 parsed_4a24 1
1 4a24.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_4a24 1
1 4a24.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_4a24 1
stop_
save_
save_CNS/XPLOR_dihedral_3
_Torsion_angle_constraint_list.Sf_category torsion_angle_constraints
_Torsion_angle_constraint_list.Entry_ID parsed_4a24
_Torsion_angle_constraint_list.ID 1
_Torsion_angle_constraint_list.Constraint_file_ID 1
_Torsion_angle_constraint_list.Block_ID 3
_Torsion_angle_constraint_list.Details "Generated by Wattos"
loop_
_Torsion_angle_constraint.ID
_Torsion_angle_constraint.Torsion_angle_name
_Torsion_angle_constraint.Assembly_atom_ID_1
_Torsion_angle_constraint.Entity_assembly_ID_1
_Torsion_angle_constraint.Entity_ID_1
_Torsion_angle_constraint.Comp_index_ID_1
_Torsion_angle_constraint.Seq_ID_1
_Torsion_angle_constraint.Comp_ID_1
_Torsion_angle_constraint.Atom_ID_1
_Torsion_angle_constraint.Resonance_ID_1
_Torsion_angle_constraint.Assembly_atom_ID_2
_Torsion_angle_constraint.Entity_assembly_ID_2
_Torsion_angle_constraint.Entity_ID_2
_Torsion_angle_constraint.Comp_index_ID_2
_Torsion_angle_constraint.Seq_ID_2
_Torsion_angle_constraint.Comp_ID_2
_Torsion_angle_constraint.Atom_ID_2
_Torsion_angle_constraint.Resonance_ID_2
_Torsion_angle_constraint.Assembly_atom_ID_3
_Torsion_angle_constraint.Entity_assembly_ID_3
_Torsion_angle_constraint.Entity_ID_3
_Torsion_angle_constraint.Comp_index_ID_3
_Torsion_angle_constraint.Seq_ID_3
_Torsion_angle_constraint.Comp_ID_3
_Torsion_angle_constraint.Atom_ID_3
_Torsion_angle_constraint.Resonance_ID_3
_Torsion_angle_constraint.Assembly_atom_ID_4
_Torsion_angle_constraint.Entity_assembly_ID_4
_Torsion_angle_constraint.Entity_ID_4
_Torsion_angle_constraint.Comp_index_ID_4
_Torsion_angle_constraint.Seq_ID_4
_Torsion_angle_constraint.Comp_ID_4
_Torsion_angle_constraint.Atom_ID_4
_Torsion_angle_constraint.Resonance_ID_4
_Torsion_angle_constraint.Angle_lower_bound_val
_Torsion_angle_constraint.Angle_upper_bound_val
_Torsion_angle_constraint.Source_experiment_ID
_Torsion_angle_constraint.Auth_asym_ID_1
_Torsion_angle_constraint.Auth_seq_ID_1
_Torsion_angle_constraint.Auth_comp_ID_1
_Torsion_angle_constraint.Auth_atom_ID_1
_Torsion_angle_constraint.Auth_asym_ID_2
_Torsion_angle_constraint.Auth_seq_ID_2
_Torsion_angle_constraint.Auth_comp_ID_2
_Torsion_angle_constraint.Auth_atom_ID_2
_Torsion_angle_constraint.Auth_asym_ID_3
_Torsion_angle_constraint.Auth_seq_ID_3
_Torsion_angle_constraint.Auth_comp_ID_3
_Torsion_angle_constraint.Auth_atom_ID_3
_Torsion_angle_constraint.Auth_asym_ID_4
_Torsion_angle_constraint.Auth_seq_ID_4
_Torsion_angle_constraint.Auth_comp_ID_4
_Torsion_angle_constraint.Auth_atom_ID_4
_Torsion_angle_constraint.Entry_ID
_Torsion_angle_constraint.Torsion_angle_constraint_list_ID
1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -108.95 -56.43 . " A" 500 . C " A" 501 . N " A" 501 . CA " A" 501 . C parsed_4a24 1
2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.74 -4.58 . " A" 501 . N " A" 501 . CA " A" 501 . C " A" 502 . N parsed_4a24 1
3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -173.96 -55.56 . " A" 501 . C " A" 502 . N " A" 502 . CA " A" 502 . C parsed_4a24 1
4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 103.86 185.64 . " A" 502 . N " A" 502 . CA " A" 502 . C " A" 503 . N parsed_4a24 1
5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -128.48 -85.64 . " A" 502 . C " A" 503 . N " A" 503 . CA " A" 503 . C parsed_4a24 1
6 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 121.13 156.05 . " A" 503 . N " A" 503 . CA " A" 503 . C " A" 504 . N parsed_4a24 1
7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -114.01 -61.69 . " A" 503 . C " A" 504 . N " A" 504 . CA " A" 504 . C parsed_4a24 1
8 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 118.27 134.49 . " A" 504 . N " A" 504 . CA " A" 504 . C " A" 505 . N parsed_4a24 1
9 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -119.24 -77.60 . " A" 505 . C " A" 506 . N " A" 506 . CA " A" 506 . C parsed_4a24 1
10 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.37 -20.21 . " A" 506 . N " A" 506 . CA " A" 506 . C " A" 507 . N parsed_4a24 1
11 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -162.99 -123.01 . " A" 506 . C " A" 507 . N " A" 507 . CA " A" 507 . C parsed_4a24 1
12 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.88 -54.98 . " A" 508 . C " A" 509 . N " A" 509 . CA " A" 509 . C parsed_4a24 1
13 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -54.71 -10.65 . " A" 509 . N " A" 509 . CA " A" 509 . C " A" 510 . N parsed_4a24 1
14 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -102.07 -49.39 . " A" 509 . C " A" 510 . N " A" 510 . CA " A" 510 . C parsed_4a24 1
15 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.88 -4.96 . " A" 510 . N " A" 510 . CA " A" 510 . C " A" 511 . N parsed_4a24 1
16 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -121.32 -80.08 . " A" 512 . C " A" 513 . N " A" 513 . CA " A" 513 . C parsed_4a24 1
17 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 122.02 154.14 . " A" 513 . N " A" 513 . CA " A" 513 . C " A" 514 . N parsed_4a24 1
18 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -143.74 -101.86 . " A" 513 . C " A" 514 . N " A" 514 . CA " A" 514 . C parsed_4a24 1
19 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.09 163.39 . " A" 514 . N " A" 514 . CA " A" 514 . C " A" 515 . N parsed_4a24 1
20 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -120.78 -71.12 . " A" 514 . C " A" 515 . N " A" 515 . CA " A" 515 . C parsed_4a24 1
21 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 119.20 139.60 . " A" 515 . N " A" 515 . CA " A" 515 . C " A" 516 . N parsed_4a24 1
22 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -76.77 -45.43 . " A" 515 . C " A" 516 . N " A" 516 . CA " A" 516 . C parsed_4a24 1
23 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 120.55 143.87 . " A" 516 . N " A" 516 . CA " A" 516 . C " A" 517 . N parsed_4a24 1
24 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -144.46 -99.08 . " A" 517 . C " A" 518 . N " A" 518 . CA " A" 518 . C parsed_4a24 1
25 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 146.91 175.97 . " A" 518 . N " A" 518 . CA " A" 518 . C " A" 519 . N parsed_4a24 1
26 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -112.27 -87.79 . " A" 519 . C " A" 520 . N " A" 520 . CA " A" 520 . C parsed_4a24 1
27 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -39.99 9.19 . " A" 520 . N " A" 520 . CA " A" 520 . C " A" 521 . N parsed_4a24 1
28 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -158.17 -119.85 . " A" 520 . C " A" 521 . N " A" 521 . CA " A" 521 . C parsed_4a24 1
29 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 135.50 175.80 . " A" 521 . N " A" 521 . CA " A" 521 . C " A" 522 . N parsed_4a24 1
30 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -155.45 -103.75 . " A" 521 . C " A" 522 . N " A" 522 . CA " A" 522 . C parsed_4a24 1
31 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 131.11 183.31 . " A" 522 . N " A" 522 . CA " A" 522 . C " A" 523 . N parsed_4a24 1
32 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -149.71 -112.91 . " A" 522 . C " A" 523 . N " A" 523 . CA " A" 523 . C parsed_4a24 1
33 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -159.68 -103.00 . " A" 523 . C " A" 524 . N " A" 524 . CA " A" 524 . C parsed_4a24 1
34 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 161.19 171.91 . " A" 525 . N " A" 525 . CA " A" 525 . C " A" 526 . N parsed_4a24 1
35 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -71.01 -53.09 . " A" 525 . C " A" 526 . N " A" 526 . CA " A" 526 . C parsed_4a24 1
36 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -44.32 -24.22 . " A" 526 . N " A" 526 . CA " A" 526 . C " A" 527 . N parsed_4a24 1
37 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.83 -61.95 . " A" 526 . C " A" 527 . N " A" 527 . CA " A" 527 . C parsed_4a24 1
38 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -47.98 -34.86 . " A" 527 . N " A" 527 . CA " A" 527 . C " A" 528 . N parsed_4a24 1
39 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.29 -56.15 . " A" 527 . C " A" 528 . N " A" 528 . CA " A" 528 . C parsed_4a24 1
40 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -49.68 -37.26 . " A" 528 . N " A" 528 . CA " A" 528 . C " A" 529 . N parsed_4a24 1
41 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -64.59 -56.37 . " A" 528 . C " A" 529 . N " A" 529 . CA " A" 529 . C parsed_4a24 1
42 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.06 -38.32 . " A" 529 . N " A" 529 . CA " A" 529 . C " A" 530 . N parsed_4a24 1
43 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.24 -59.64 . " A" 529 . C " A" 530 . N " A" 530 . CA " A" 530 . C parsed_4a24 1
44 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -42.58 -29.68 . " A" 530 . N " A" 530 . CA " A" 530 . C " A" 531 . N parsed_4a24 1
45 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -73.29 -58.55 . " A" 530 . C " A" 531 . N " A" 531 . CA " A" 531 . C parsed_4a24 1
46 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.32 -19.60 . " A" 531 . N " A" 531 . CA " A" 531 . C " A" 532 . N parsed_4a24 1
47 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -111.03 -70.27 . " A" 531 . C " A" 532 . N " A" 532 . CA " A" 532 . C parsed_4a24 1
48 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -41.34 -1.90 . " A" 532 . N " A" 532 . CA " A" 532 . C " A" 533 . N parsed_4a24 1
49 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.30 -55.98 . " A" 532 . C " A" 533 . N " A" 533 . CA " A" 533 . C parsed_4a24 1
50 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -52.44 -27.20 . " A" 533 . N " A" 533 . CA " A" 533 . C " A" 534 . N parsed_4a24 1
51 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -69.01 -54.45 . " A" 533 . C " A" 534 . N " A" 534 . CA " A" 534 . C parsed_4a24 1
52 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.79 -28.23 . " A" 534 . N " A" 534 . CA " A" 534 . C " A" 535 . N parsed_4a24 1
53 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -91.54 -62.12 . " A" 534 . C " A" 535 . N " A" 535 . CA " A" 535 . C parsed_4a24 1
54 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -56.29 -16.91 . " A" 535 . N " A" 535 . CA " A" 535 . C " A" 536 . N parsed_4a24 1
55 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -67.84 -55.52 . " A" 535 . C " A" 536 . N " A" 536 . CA " A" 536 . C parsed_4a24 1
56 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -46.49 -33.21 . " A" 536 . N " A" 536 . CA " A" 536 . C " A" 537 . N parsed_4a24 1
57 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -77.49 -52.07 . " A" 536 . C " A" 537 . N " A" 537 . CA " A" 537 . C parsed_4a24 1
58 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -48.55 -12.51 . " A" 537 . N " A" 537 . CA " A" 537 . C " A" 538 . N parsed_4a24 1
59 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -83.34 -61.46 . " A" 537 . C " A" 538 . N " A" 538 . CA " A" 538 . C parsed_4a24 1
60 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -43.46 -16.12 . " A" 538 . N " A" 538 . CA " A" 538 . C " A" 539 . N parsed_4a24 1
61 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . -97.09 -57.31 . " A" 539 . C " A" 540 . N " A" 540 . CA " A" 540 . C parsed_4a24 1
62 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 126.37 152.83 . " A" 540 . N " A" 540 . CA " A" 540 . C " A" 541 . N parsed_4a24 1
stop_
save_
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