NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
583692 |
2mjg   |
18939 | cing | 2-parsed | STAR | dipolar coupling | 72 |
data_2mjg_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mjg
_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_2mjg 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mjg
_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 2mjg "Master copy" parsed_2mjg
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mjg
_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 2mjg.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mjg 1
1 2mjg.mr . . DYANA/DIANA 2 distance "hydrogen bond" simple 56 parsed_2mjg 1
1 2mjg.mr . . DYANA/DIANA 3 distance NOE simple 1450 parsed_2mjg 1
1 2mjg.mr . . DYANA/DIANA 4 "dihedral angle" "Not applicable" "Not applicable" 126 parsed_2mjg 1
1 2mjg.mr . . DYANA/DIANA 5 distance NOE simple 0 parsed_2mjg 1
1 2mjg.mr . . "MR format" 6 comment "Not applicable" "Not applicable" 0 parsed_2mjg 1
1 2mjg.mr . . DYANA/DIANA 7 "dipolar coupling" "Not applicable" "Not applicable" 72 parsed_2mjg 1
1 2mjg.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mjg 1
stop_
save_
save_DYANA/DIANA_dipolar_coupling_7
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2mjg
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 7
_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 . . . . . . . . . . . . . . . . -6.950 . . 2.000 . . 8 VAL H . 8 VAL N parsed_2mjg 1
2 . . . . . . . . . . . . . . . . 9.580 . . 2.000 . . 9 THR H . 9 THR N parsed_2mjg 1
3 . . . . . . . . . . . . . . . . -0.070 . . 2.000 . . 10 GLY H . 10 GLY N parsed_2mjg 1
4 . . . . . . . . . . . . . . . . -9.290 . . 2.000 . . 11 GLU H . 11 GLU N parsed_2mjg 1
5 . . . . . . . . . . . . . . . . 10.640 . . 2.000 . . 12 VAL H . 12 VAL N parsed_2mjg 1
6 . . . . . . . . . . . . . . . . 0.000 . . 2.000 . . 13 SER H . 13 SER N parsed_2mjg 1
7 . . . . . . . . . . . . . . . . 15.750 . . 2.000 . . 15 ASP H . 15 ASP N parsed_2mjg 1
8 . . . . . . . . . . . . . . . . -5.890 . . 2.000 . . 16 ASN H . 16 ASN N parsed_2mjg 1
9 . . . . . . . . . . . . . . . . 10.780 . . 2.000 . . 17 LEU H . 17 LEU N parsed_2mjg 1
10 . . . . . . . . . . . . . . . . -3.120 . . 2.000 . . 18 LYS H . 18 LYS N parsed_2mjg 1
11 . . . . . . . . . . . . . . . . 7.450 . . 2.000 . . 19 LEU H . 19 LEU N parsed_2mjg 1
12 . . . . . . . . . . . . . . . . -2.480 . . 2.000 . . 20 ALA H . 20 ALA N parsed_2mjg 1
13 . . . . . . . . . . . . . . . . -4.970 . . 2.000 . . 21 GLY H . 21 GLY N parsed_2mjg 1
14 . . . . . . . . . . . . . . . . -5.750 . . 2.000 . . 22 GLY H . 22 GLY N parsed_2mjg 1
15 . . . . . . . . . . . . . . . . 5.960 . . 2.000 . . 23 LYS H . 23 LYS N parsed_2mjg 1
16 . . . . . . . . . . . . . . . . 4.190 . . 2.000 . . 24 LEU H . 24 LEU N parsed_2mjg 1
17 . . . . . . . . . . . . . . . . 0.710 . . 2.000 . . 25 VAL H . 25 VAL N parsed_2mjg 1
18 . . . . . . . . . . . . . . . . -12.270 . . 2.000 . . 28 LYS H . 28 LYS N parsed_2mjg 1
19 . . . . . . . . . . . . . . . . -10.430 . . 2.000 . . 29 GLU H . 29 GLU N parsed_2mjg 1
20 . . . . . . . . . . . . . . . . -11.140 . . 2.000 . . 30 GLY H . 30 GLY N parsed_2mjg 1
21 . . . . . . . . . . . . . . . . -13.830 . . 2.000 . . 31 ALA H . 31 ALA N parsed_2mjg 1
22 . . . . . . . . . . . . . . . . -11.710 . . 2.000 . . 32 GLU H . 32 GLU N parsed_2mjg 1
23 . . . . . . . . . . . . . . . . -6.600 . . 2.000 . . 33 GLN H . 33 GLN N parsed_2mjg 1
24 . . . . . . . . . . . . . . . . -10.570 . . 2.000 . . 34 ILE H . 34 ILE N parsed_2mjg 1
25 . . . . . . . . . . . . . . . . -15.680 . . 2.000 . . 35 ILE H . 35 ILE N parsed_2mjg 1
26 . . . . . . . . . . . . . . . . -12.060 . . 2.000 . . 36 SER H . 36 SER N parsed_2mjg 1
27 . . . . . . . . . . . . . . . . -12.560 . . 2.000 . . 37 GLU H . 37 GLU N parsed_2mjg 1
28 . . . . . . . . . . . . . . . . -15.610 . . 2.000 . . 38 ILE H . 38 ILE N parsed_2mjg 1
29 . . . . . . . . . . . . . . . . -13.340 . . 2.000 . . 39 GLN H . 39 GLN N parsed_2mjg 1
30 . . . . . . . . . . . . . . . . -10.850 . . 2.000 . . 40 ASN H . 40 ASN N parsed_2mjg 1
31 . . . . . . . . . . . . . . . . -11.490 . . 2.000 . . 41 GLN H . 41 GLN N parsed_2mjg 1
32 . . . . . . . . . . . . . . . . -13.620 . . 2.000 . . 42 LEU H . 42 LEU N parsed_2mjg 1
33 . . . . . . . . . . . . . . . . -5.890 . . 2.000 . . 43 GLN H . 43 GLN N parsed_2mjg 1
34 . . . . . . . . . . . . . . . . -4.330 . . 2.000 . . 44 ASN H . 44 ASN N parsed_2mjg 1
35 . . . . . . . . . . . . . . . . -4.110 . . 2.000 . . 45 LEU H . 45 LEU N parsed_2mjg 1
36 . . . . . . . . . . . . . . . . 2.200 . . 2.000 . . 46 LYS H . 46 LYS N parsed_2mjg 1
37 . . . . . . . . . . . . . . . . -6.950 . . 2.000 . . 408 VAL H . 408 VAL N parsed_2mjg 1
38 . . . . . . . . . . . . . . . . 9.580 . . 2.000 . . 409 THR H . 409 THR N parsed_2mjg 1
39 . . . . . . . . . . . . . . . . -0.070 . . 2.000 . . 410 GLY H . 410 GLY N parsed_2mjg 1
40 . . . . . . . . . . . . . . . . -9.290 . . 2.000 . . 411 GLU H . 411 GLU N parsed_2mjg 1
41 . . . . . . . . . . . . . . . . 10.640 . . 2.000 . . 412 VAL H . 412 VAL N parsed_2mjg 1
42 . . . . . . . . . . . . . . . . 0.000 . . 2.000 . . 413 SER H . 413 SER N parsed_2mjg 1
43 . . . . . . . . . . . . . . . . 15.750 . . 2.000 . . 415 ASP H . 415 ASP N parsed_2mjg 1
44 . . . . . . . . . . . . . . . . -5.890 . . 2.000 . . 416 ASN H . 416 ASN N parsed_2mjg 1
45 . . . . . . . . . . . . . . . . 10.780 . . 2.000 . . 417 LEU H . 417 LEU N parsed_2mjg 1
46 . . . . . . . . . . . . . . . . -3.120 . . 2.000 . . 418 LYS H . 418 LYS N parsed_2mjg 1
47 . . . . . . . . . . . . . . . . 7.450 . . 2.000 . . 419 LEU H . 419 LEU N parsed_2mjg 1
48 . . . . . . . . . . . . . . . . -2.480 . . 2.000 . . 420 ALA H . 420 ALA N parsed_2mjg 1
49 . . . . . . . . . . . . . . . . -4.970 . . 2.000 . . 421 GLY H . 421 GLY N parsed_2mjg 1
50 . . . . . . . . . . . . . . . . -5.750 . . 2.000 . . 422 GLY H . 422 GLY N parsed_2mjg 1
51 . . . . . . . . . . . . . . . . 5.960 . . 2.000 . . 423 LYS H . 423 LYS N parsed_2mjg 1
52 . . . . . . . . . . . . . . . . 4.190 . . 2.000 . . 424 LEU H . 424 LEU N parsed_2mjg 1
53 . . . . . . . . . . . . . . . . 0.710 . . 2.000 . . 425 VAL H . 425 VAL N parsed_2mjg 1
54 . . . . . . . . . . . . . . . . -12.270 . . 2.000 . . 428 LYS H . 428 LYS N parsed_2mjg 1
55 . . . . . . . . . . . . . . . . -10.430 . . 2.000 . . 429 GLU H . 429 GLU N parsed_2mjg 1
56 . . . . . . . . . . . . . . . . -11.140 . . 2.000 . . 430 GLY H . 430 GLY N parsed_2mjg 1
57 . . . . . . . . . . . . . . . . -13.830 . . 2.000 . . 431 ALA H . 431 ALA N parsed_2mjg 1
58 . . . . . . . . . . . . . . . . -11.710 . . 2.000 . . 432 GLU H . 432 GLU N parsed_2mjg 1
59 . . . . . . . . . . . . . . . . -6.600 . . 2.000 . . 433 GLN H . 433 GLN N parsed_2mjg 1
60 . . . . . . . . . . . . . . . . -10.570 . . 2.000 . . 434 ILE H . 434 ILE N parsed_2mjg 1
61 . . . . . . . . . . . . . . . . -15.680 . . 2.000 . . 435 ILE H . 435 ILE N parsed_2mjg 1
62 . . . . . . . . . . . . . . . . -12.060 . . 2.000 . . 436 SER H . 436 SER N parsed_2mjg 1
63 . . . . . . . . . . . . . . . . -12.560 . . 2.000 . . 437 GLU H . 437 GLU N parsed_2mjg 1
64 . . . . . . . . . . . . . . . . -15.610 . . 2.000 . . 438 ILE H . 438 ILE N parsed_2mjg 1
65 . . . . . . . . . . . . . . . . -13.340 . . 2.000 . . 439 GLN H . 439 GLN N parsed_2mjg 1
66 . . . . . . . . . . . . . . . . -10.850 . . 2.000 . . 440 ASN H . 440 ASN N parsed_2mjg 1
67 . . . . . . . . . . . . . . . . -11.490 . . 2.000 . . 441 GLN H . 441 GLN N parsed_2mjg 1
68 . . . . . . . . . . . . . . . . -13.620 . . 2.000 . . 442 LEU H . 442 LEU N parsed_2mjg 1
69 . . . . . . . . . . . . . . . . -5.890 . . 2.000 . . 443 GLN H . 443 GLN N parsed_2mjg 1
70 . . . . . . . . . . . . . . . . -4.330 . . 2.000 . . 444 ASN H . 444 ASN N parsed_2mjg 1
71 . . . . . . . . . . . . . . . . -4.110 . . 2.000 . . 445 LEU H . 445 LEU N parsed_2mjg 1
72 . . . . . . . . . . . . . . . . 2.200 . . 2.000 . . 446 LYS H . 446 LYS N parsed_2mjg 1
stop_
loop_
_RDC_constraint_parse_err.ID
_RDC_constraint_parse_err.Content
_RDC_constraint_parse_err.Begin_line
_RDC_constraint_parse_err.Begin_column
_RDC_constraint_parse_err.End_line
_RDC_constraint_parse_err.End_column
_RDC_constraint_parse_err.Entry_ID
_RDC_constraint_parse_err.RDC_constraint_list_ID
1 1 1 63 1 64 parsed_2mjg 1
2 1 2 63 2 64 parsed_2mjg 1
3 1 3 63 3 64 parsed_2mjg 1
4 1 4 63 4 64 parsed_2mjg 1
5 1 5 63 5 64 parsed_2mjg 1
6 1 6 63 6 64 parsed_2mjg 1
7 1 7 63 7 64 parsed_2mjg 1
8 1 8 63 8 64 parsed_2mjg 1
9 1 9 63 9 64 parsed_2mjg 1
10 1 10 63 10 64 parsed_2mjg 1
11 1 11 63 11 64 parsed_2mjg 1
12 1 12 63 12 64 parsed_2mjg 1
13 1 13 63 13 64 parsed_2mjg 1
14 1 14 63 14 64 parsed_2mjg 1
15 1 15 63 15 64 parsed_2mjg 1
16 1 16 63 16 64 parsed_2mjg 1
17 1 17 63 17 64 parsed_2mjg 1
18 1 18 63 18 64 parsed_2mjg 1
19 1 19 63 19 64 parsed_2mjg 1
20 1 20 63 20 64 parsed_2mjg 1
21 1 21 63 21 64 parsed_2mjg 1
22 1 22 63 22 64 parsed_2mjg 1
23 1 23 63 23 64 parsed_2mjg 1
24 1 24 63 24 64 parsed_2mjg 1
25 1 25 63 25 64 parsed_2mjg 1
26 1 26 63 26 64 parsed_2mjg 1
27 1 27 63 27 64 parsed_2mjg 1
28 1 28 63 28 64 parsed_2mjg 1
29 1 29 63 29 64 parsed_2mjg 1
30 1 30 63 30 64 parsed_2mjg 1
31 1 31 63 31 64 parsed_2mjg 1
32 1 32 63 32 64 parsed_2mjg 1
33 1 33 63 33 64 parsed_2mjg 1
34 1 34 63 34 64 parsed_2mjg 1
35 1 35 63 35 64 parsed_2mjg 1
36 1 36 63 36 64 parsed_2mjg 1
37 1 37 63 37 64 parsed_2mjg 1
38 1 38 63 38 64 parsed_2mjg 1
39 1 39 63 39 64 parsed_2mjg 1
40 1 40 63 40 64 parsed_2mjg 1
41 1 41 63 41 64 parsed_2mjg 1
42 1 42 63 42 64 parsed_2mjg 1
43 1 43 63 43 64 parsed_2mjg 1
44 1 44 63 44 64 parsed_2mjg 1
45 1 45 63 45 64 parsed_2mjg 1
46 1 46 63 46 64 parsed_2mjg 1
47 1 47 63 47 64 parsed_2mjg 1
48 1 48 63 48 64 parsed_2mjg 1
49 1 49 63 49 64 parsed_2mjg 1
50 1 50 63 50 64 parsed_2mjg 1
51 1 51 63 51 64 parsed_2mjg 1
52 1 52 63 52 64 parsed_2mjg 1
53 1 53 63 53 64 parsed_2mjg 1
54 1 54 63 54 64 parsed_2mjg 1
55 1 55 63 55 64 parsed_2mjg 1
56 1 56 63 56 64 parsed_2mjg 1
57 1 57 63 57 64 parsed_2mjg 1
58 1 58 63 58 64 parsed_2mjg 1
59 1 59 63 59 64 parsed_2mjg 1
60 1 60 63 60 64 parsed_2mjg 1
61 1 61 63 61 64 parsed_2mjg 1
62 1 62 63 62 64 parsed_2mjg 1
63 1 63 63 63 64 parsed_2mjg 1
64 1 64 63 64 64 parsed_2mjg 1
65 1 65 63 65 64 parsed_2mjg 1
66 1 66 63 66 64 parsed_2mjg 1
67 1 67 63 67 64 parsed_2mjg 1
68 1 68 63 68 64 parsed_2mjg 1
69 1 69 63 69 64 parsed_2mjg 1
70 1 70 63 70 64 parsed_2mjg 1
71 1 71 63 71 64 parsed_2mjg 1
72
;
1
;
72 63 73 1 parsed_2mjg 1
stop_
save_
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