NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
562996 |
2lxs   |
18694 | cing | 2-parsed | STAR | dipolar coupling | 80 |
data_2lxs_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lxs
_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_2lxs 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lxs
_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 2lxs "Master copy" parsed_2lxs
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lxs
_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 2lxs.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lxs 1
1 2lxs.mr . . XPLOR/CNS 2 distance NOE simple 1016 parsed_2lxs 1
1 2lxs.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 184 parsed_2lxs 1
1 2lxs.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 80 parsed_2lxs 1
1 2lxs.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lxs 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2lxs
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . 0.4127 . . . . " A" 586 . N " A" 586 . HN parsed_2lxs 1
2 . . . . . . . . . . . . . . . . -0.5592 . . . . " A" 587 . N " A" 587 . HN parsed_2lxs 1
3 . . . . . . . . . . . . . . . . -1.5362 . . . . " A" 588 . N " A" 588 . HN parsed_2lxs 1
4 . . . . . . . . . . . . . . . . -0.9573 . . . . " A" 589 . N " A" 589 . HN parsed_2lxs 1
5 . . . . . . . . . . . . . . . . 1.1310 . . . . " A" 590 . N " A" 590 . HN parsed_2lxs 1
6 . . . . . . . . . . . . . . . . 2.3159 . . . . " A" 591 . N " A" 591 . HN parsed_2lxs 1
7 . . . . . . . . . . . . . . . . 7.1776 . . . . " A" 591 . NE1 " A" 591 . HE1 parsed_2lxs 1
8 . . . . . . . . . . . . . . . . 3.3734 . . . . " A" 592 . N " A" 592 . HN parsed_2lxs 1
9 . . . . . . . . . . . . . . . . -1.6663 . . . . " A" 593 . N " A" 593 . HN parsed_2lxs 1
10 . . . . . . . . . . . . . . . . 2.3491 . . . . " A" 594 . N " A" 594 . HN parsed_2lxs 1
11 . . . . . . . . . . . . . . . . 3.4585 . . . . " A" 595 . N " A" 595 . HN parsed_2lxs 1
12 . . . . . . . . . . . . . . . . 5.6380 . . . . " A" 596 . N " A" 596 . HN parsed_2lxs 1
13 . . . . . . . . . . . . . . . . -5.9522 . . . . " A" 597 . N " A" 597 . HN parsed_2lxs 1
14 . . . . . . . . . . . . . . . . -9.3163 . . . . " A" 598 . N " A" 598 . HN parsed_2lxs 1
15 . . . . . . . . . . . . . . . . -11.6111 . . . . " A" 599 . N " A" 599 . HN parsed_2lxs 1
16 . . . . . . . . . . . . . . . . -8.8359 . . . . " A" 600 . N " A" 600 . HN parsed_2lxs 1
17 . . . . . . . . . . . . . . . . -7.6748 . . . . " A" 601 . N " A" 601 . HN parsed_2lxs 1
18 . . . . . . . . . . . . . . . . -10.2097 . . . . " A" 602 . N " A" 602 . HN parsed_2lxs 1
19 . . . . . . . . . . . . . . . . -9.6637 . . . . " A" 603 . N " A" 603 . HN parsed_2lxs 1
20 . . . . . . . . . . . . . . . . -6.5308 . . . . " A" 604 . N " A" 604 . HN parsed_2lxs 1
21 . . . . . . . . . . . . . . . . -7.9824 . . . . " A" 605 . N " A" 605 . HN parsed_2lxs 1
22 . . . . . . . . . . . . . . . . -8.1152 . . . . " A" 608 . N " A" 608 . HN parsed_2lxs 1
23 . . . . . . . . . . . . . . . . -10.3255 . . . . " A" 609 . N " A" 609 . HN parsed_2lxs 1
24 . . . . . . . . . . . . . . . . -8.1627 . . . . " A" 610 . N " A" 610 . HN parsed_2lxs 1
25 . . . . . . . . . . . . . . . . -7.3188 . . . . " A" 611 . N " A" 611 . HN parsed_2lxs 1
26 . . . . . . . . . . . . . . . . -9.0748 . . . . " A" 612 . N " A" 612 . HN parsed_2lxs 1
27 . . . . . . . . . . . . . . . . -1.7099 . . . . " A" 614 . N " A" 614 . HN parsed_2lxs 1
28 . . . . . . . . . . . . . . . . 2.2733 . . . . " A" 616 . N " A" 616 . HN parsed_2lxs 1
29 . . . . . . . . . . . . . . . . 0.8678 . . . . " A" 618 . N " A" 618 . HN parsed_2lxs 1
30 . . . . . . . . . . . . . . . . 4.8062 . . . . " A" 619 . N " A" 619 . HN parsed_2lxs 1
31 . . . . . . . . . . . . . . . . 3.6022 . . . . " A" 620 . N " A" 620 . HN parsed_2lxs 1
32 . . . . . . . . . . . . . . . . -4.5982 . . . . " A" 621 . N " A" 621 . HN parsed_2lxs 1
33 . . . . . . . . . . . . . . . . 6.6736 . . . . " A" 622 . N " A" 622 . HN parsed_2lxs 1
34 . . . . . . . . . . . . . . . . -5.0771 . . . . " A" 623 . N " A" 623 . HN parsed_2lxs 1
35 . . . . . . . . . . . . . . . . -7.6517 . . . . " A" 624 . N " A" 624 . HN parsed_2lxs 1
36 . . . . . . . . . . . . . . . . -5.2751 . . . . " A" 626 . N " A" 626 . HN parsed_2lxs 1
37 . . . . . . . . . . . . . . . . -9.5503 . . . . " A" 627 . N " A" 627 . HN parsed_2lxs 1
38 . . . . . . . . . . . . . . . . -4.8699 . . . . " A" 628 . N " A" 628 . HN parsed_2lxs 1
39 . . . . . . . . . . . . . . . . -4.3499 . . . . " A" 629 . N " A" 629 . HN parsed_2lxs 1
40 . . . . . . . . . . . . . . . . -7.6208 . . . . " A" 630 . N " A" 630 . HN parsed_2lxs 1
41 . . . . . . . . . . . . . . . . -8.2348 . . . . " A" 631 . N " A" 631 . HN parsed_2lxs 1
42 . . . . . . . . . . . . . . . . -4.9891 . . . . " A" 632 . N " A" 632 . HN parsed_2lxs 1
43 . . . . . . . . . . . . . . . . -4.6762 . . . . " A" 633 . N " A" 633 . HN parsed_2lxs 1
44 . . . . . . . . . . . . . . . . -9.5688 . . . . " A" 634 . N " A" 634 . HN parsed_2lxs 1
45 . . . . . . . . . . . . . . . . -8.7786 . . . . " A" 635 . N " A" 635 . HN parsed_2lxs 1
46 . . . . . . . . . . . . . . . . -6.5078 . . . . " A" 636 . N " A" 636 . HN parsed_2lxs 1
47 . . . . . . . . . . . . . . . . -7.7910 . . . . " A" 637 . N " A" 637 . HN parsed_2lxs 1
48 . . . . . . . . . . . . . . . . -9.4411 . . . . " A" 638 . N " A" 638 . HN parsed_2lxs 1
49 . . . . . . . . . . . . . . . . -5.9342 . . . . " A" 639 . N " A" 639 . HN parsed_2lxs 1
50 . . . . . . . . . . . . . . . . -7.1277 . . . . " A" 640 . N " A" 640 . HN parsed_2lxs 1
51 . . . . . . . . . . . . . . . . -8.1862 . . . . " A" 641 . N " A" 641 . HN parsed_2lxs 1
52 . . . . . . . . . . . . . . . . -6.9401 . . . . " A" 642 . N " A" 642 . HN parsed_2lxs 1
53 . . . . . . . . . . . . . . . . -1.2298 . . . . " A" 643 . N " A" 643 . HN parsed_2lxs 1
54 . . . . . . . . . . . . . . . . -0.7589 . . . . " A" 644 . N " A" 644 . HN parsed_2lxs 1
55 . . . . . . . . . . . . . . . . -9.9170 . . . . " A" 646 . N " A" 646 . HN parsed_2lxs 1
56 . . . . . . . . . . . . . . . . -10.3331 . . . . " A" 647 . N " A" 647 . HN parsed_2lxs 1
57 . . . . . . . . . . . . . . . . -10.7808 . . . . " A" 648 . N " A" 648 . HN parsed_2lxs 1
58 . . . . . . . . . . . . . . . . -9.5852 . . . . " A" 649 . N " A" 649 . HN parsed_2lxs 1
59 . . . . . . . . . . . . . . . . -6.2207 . . . . " A" 650 . N " A" 650 . HN parsed_2lxs 1
60 . . . . . . . . . . . . . . . . -7.8849 . . . . " A" 651 . N " A" 651 . HN parsed_2lxs 1
61 . . . . . . . . . . . . . . . . -10.3217 . . . . " A" 652 . N " A" 652 . HN parsed_2lxs 1
62 . . . . . . . . . . . . . . . . -9.6608 . . . . " A" 653 . N " A" 653 . HN parsed_2lxs 1
63 . . . . . . . . . . . . . . . . -9.9249 . . . . " A" 654 . N " A" 654 . HN parsed_2lxs 1
64 . . . . . . . . . . . . . . . . -10.5759 . . . . " A" 655 . N " A" 655 . HN parsed_2lxs 1
65 . . . . . . . . . . . . . . . . -9.3743 . . . . " A" 656 . N " A" 656 . HN parsed_2lxs 1
66 . . . . . . . . . . . . . . . . -8.8732 . . . . " A" 657 . N " A" 657 . HN parsed_2lxs 1
67 . . . . . . . . . . . . . . . . -10.8908 . . . . " A" 659 . N " A" 659 . HN parsed_2lxs 1
68 . . . . . . . . . . . . . . . . -9.9284 . . . . " A" 660 . N " A" 660 . HN parsed_2lxs 1
69 . . . . . . . . . . . . . . . . -8.1558 . . . . " A" 661 . N " A" 661 . HN parsed_2lxs 1
70 . . . . . . . . . . . . . . . . -8.2925 . . . . " A" 662 . N " A" 662 . HN parsed_2lxs 1
71 . . . . . . . . . . . . . . . . -9.5148 . . . . " A" 663 . N " A" 663 . HN parsed_2lxs 1
72 . . . . . . . . . . . . . . . . -9.3890 . . . . " A" 664 . N " A" 664 . HN parsed_2lxs 1
73 . . . . . . . . . . . . . . . . -10.2336 . . . . " A" 665 . N " A" 665 . HN parsed_2lxs 1
74 . . . . . . . . . . . . . . . . -9.9141 . . . . " A" 666 . N " A" 666 . HN parsed_2lxs 1
75 . . . . . . . . . . . . . . . . -8.6324 . . . . " A" 667 . N " A" 667 . HN parsed_2lxs 1
76 . . . . . . . . . . . . . . . . -8.1465 . . . . " A" 668 . N " A" 668 . HN parsed_2lxs 1
77 . . . . . . . . . . . . . . . . -8.4307 . . . . " A" 669 . N " A" 669 . HN parsed_2lxs 1
78 . . . . . . . . . . . . . . . . -5.2234 . . . . " A" 670 . N " A" 670 . HN parsed_2lxs 1
79 . . . . . . . . . . . . . . . . -0.4067 . . . . " A" 671 . N " A" 671 . HN parsed_2lxs 1
80 . . . . . . . . . . . . . . . . 0.0509 . . . . " A" 672 . N " A" 672 . HN parsed_2lxs 1
stop_
save_
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