NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
34318 |
1jox   |
cing | 2-parsed | STAR | dipolar coupling | 56 |
data_1jox_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1jox
_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_1jox 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1jox
_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 1jox "Master copy" parsed_1jox
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1jox
_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 1jox.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1jox 1
1 1jox.mr . . XPLOR/CNS 2 distance NOE ambi 363 parsed_1jox 1
1 1jox.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 40 parsed_1jox 1
1 1jox.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 4 parsed_1jox 1
1 1jox.mr . . XPLOR/CNS 5 planarity "Not applicable" "Not applicable" 0 parsed_1jox 1
1 1jox.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 56 parsed_1jox 1
1 1jox.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1jox 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_6
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_1jox
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . 4.2700 . . . . . 1 . C8 . 1 . H8 parsed_1jox 1
2 . . . . . . . . . . . . . . . . 7.6000 . . . . . 2 . C8 . 2 . H8 parsed_1jox 1
3 . . . . . . . . . . . . . . . . -6.590 . . . . . 3 . C6 . 3 . H6 parsed_1jox 1
4 . . . . . . . . . . . . . . . . -9.510 . . . . . 4 . C8 . 4 . H8 parsed_1jox 1
5 . . . . . . . . . . . . . . . . -18.27 . . . . . 5 . C8 . 5 . H8 parsed_1jox 1
6 . . . . . . . . . . . . . . . . -11.12 . . . . . 7 . C8 . 7 . H8 parsed_1jox 1
7 . . . . . . . . . . . . . . . . -0.939 . . . . . 8 . C6 . 8 . H6 parsed_1jox 1
8 . . . . . . . . . . . . . . . . -3.170 . . . . . 15 . C8 . 15 . H8 parsed_1jox 1
9 . . . . . . . . . . . . . . . . -5.650 . . . . . 16 . C6 . 16 . H6 parsed_1jox 1
10 . . . . . . . . . . . . . . . . -14.12 . . . . . 17 . C6 . 17 . H6 parsed_1jox 1
11 . . . . . . . . . . . . . . . . -14.12 . . . . . 18 . C6 . 18 . H6 parsed_1jox 1
12 . . . . . . . . . . . . . . . . -14.30 . . . . . 19 . C8 . 19 . H8 parsed_1jox 1
13 . . . . . . . . . . . . . . . . 9.5300 . . . . . 21 . C6 . 21 . H6 parsed_1jox 1
14 . . . . . . . . . . . . . . . . 14.860 . . . . . 2 . C1' . 2 . H1' parsed_1jox 1
15 . . . . . . . . . . . . . . . . 12.630 . . . . . 3 . C1' . 3 . H1' parsed_1jox 1
16 . . . . . . . . . . . . . . . . 5.9400 . . . . . 4 . C1' . 4 . H1' parsed_1jox 1
17 . . . . . . . . . . . . . . . . 9.883 . . . . . 5 . C1' . 5 . H1' parsed_1jox 1
18 . . . . . . . . . . . . . . . . -7.430 . . . . . 8 . C1' . 8 . H1' parsed_1jox 1
19 . . . . . . . . . . . . . . . . 3.1200 . . . . . 10 . C1' . 10 . H1' parsed_1jox 1
20 . . . . . . . . . . . . . . . . -18.21 . . . . . 11 . C1' . 11 . H1' parsed_1jox 1
21 . . . . . . . . . . . . . . . . -2.160 . . . . . 12 . C1' . 12 . H1' parsed_1jox 1
22 . . . . . . . . . . . . . . . . 13.570 . . . . . 15 . C1' . 15 . H1' parsed_1jox 1
23 . . . . . . . . . . . . . . . . 10.400 . . . . . 16 . C1' . 16 . H1' parsed_1jox 1
24 . . . . . . . . . . . . . . . . 0.7400 . . . . . 17 . C1' . 17 . H1' parsed_1jox 1
25 . . . . . . . . . . . . . . . . -6.680 . . . . . 18 . C1' . 18 . H1' parsed_1jox 1
26 . . . . . . . . . . . . . . . . -8.920 . . . . . 19 . C1' . 19 . H1' parsed_1jox 1
27 . . . . . . . . . . . . . . . . -6.240 . . . . . 21 . C1' . 21 . H1' parsed_1jox 1
28 . . . . . . . . . . . . . . . . 10.850 . . . . . 1 . C2' . 1 . H2' parsed_1jox 1
29 . . . . . . . . . . . . . . . . 0.7200 . . . . . 2 . C2' . 2 . H2' parsed_1jox 1
30 . . . . . . . . . . . . . . . . 2.1700 . . . . . 3 . C2' . 3 . H2' parsed_1jox 1
31 . . . . . . . . . . . . . . . . 5.7900 . . . . . 4 . C2' . 4 . H2' parsed_1jox 1
32 . . . . . . . . . . . . . . . . 9.4100 . . . . . 5 . C2' . 5 . H2' parsed_1jox 1
33 . . . . . . . . . . . . . . . . -2.170 . . . . . 8 . C2' . 8 . H2' parsed_1jox 1
34 . . . . . . . . . . . . . . . . 7.9600 . . . . . 10 . C2' . 10 . H2' parsed_1jox 1
35 . . . . . . . . . . . . . . . . 0.7200 . . . . . 11 . C2' . 11 . H2' parsed_1jox 1
36 . . . . . . . . . . . . . . . . -10.78 . . . . . 12 . C2' . 12 . H2' parsed_1jox 1
37 . . . . . . . . . . . . . . . . 11.580 . . . . . 15 . C2' . 15 . H2' parsed_1jox 1
38 . . . . . . . . . . . . . . . . -1.450 . . . . . 16 . C2' . 16 . H2' parsed_1jox 1
39 . . . . . . . . . . . . . . . . -3.850 . . . . . 17 . C2' . 17 . H2' parsed_1jox 1
40 . . . . . . . . . . . . . . . . -4.340 . . . . . 18 . C2' . 18 . H2' parsed_1jox 1
41 . . . . . . . . . . . . . . . . -2.170 . . . . . 19 . C2' . 19 . H2' parsed_1jox 1
42 . . . . . . . . . . . . . . . . -7.850 . . . . . 21 . C2' . 21 . H2' parsed_1jox 1
43 . . . . . . . . . . . . . . . . 15.580 . . . . . 1 . C3' . 1 . H3' parsed_1jox 1
44 . . . . . . . . . . . . . . . . 0.5500 . . . . . 2 . C3' . 2 . H3' parsed_1jox 1
45 . . . . . . . . . . . . . . . . 8.3200 . . . . . 8 . C3' . 8 . H3' parsed_1jox 1
46 . . . . . . . . . . . . . . . . -15.68 . . . . . 10 . C3' . 10 . H3' parsed_1jox 1
47 . . . . . . . . . . . . . . . . 4.9900 . . . . . 11 . C3' . 11 . H3' parsed_1jox 1
48 . . . . . . . . . . . . . . . . -2.730 . . . . . 12 . C3' . 12 . H3' parsed_1jox 1
49 . . . . . . . . . . . . . . . . -5.540 . . . . . 19 . C3' . 19 . H3' parsed_1jox 1
50 . . . . . . . . . . . . . . . . -11.03 . . . . . 21 . C3' . 21 . H3' parsed_1jox 1
51 . . . . . . . . . . . . . . . . 4.6300 . . . . . 1 . C4' . 1 . H4' parsed_1jox 1
52 . . . . . . . . . . . . . . . . 3.2700 . . . . . 5 . C4' . 5 . H4' parsed_1jox 1
53 . . . . . . . . . . . . . . . . -1.580 . . . . . 10 . C4' . 10 . H4' parsed_1jox 1
54 . . . . . . . . . . . . . . . . 11.190 . . . . . 11 . C4' . 11 . H4' parsed_1jox 1
55 . . . . . . . . . . . . . . . . -5.800 . . . . . 12 . C4' . 12 . H4' parsed_1jox 1
56 . . . . . . . . . . . . . . . . -10.47 . . . . . 21 . C4' . 21 . H4' parsed_1jox 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 "Residual Dipolar Coupling (Sani) restraints" 1 1 3 2 parsed_1jox 1
stop_
save_
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