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 |
|
|
54654 |
4gat   |
cing | 2-parsed | STAR | dipolar coupling | 48 |
data_4gat_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_4gat
_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_4gat 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_4gat
_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 4gat "Master copy" parsed_4gat
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_4gat
_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 4gat.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 3 distance NOE ambi 280 parsed_4gat 1
1 4gat.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 5 distance NOE simple 210 parsed_4gat 1
1 4gat.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 7 distance NOE ambi 48 parsed_4gat 1
1 4gat.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 9 distance "hydrogen bond" simple 20 parsed_4gat 1
1 4gat.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 11 distance "hydrogen bond" simple 66 parsed_4gat 1
1 4gat.mr . . n/a 12 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 13 distance "hydrogen bond" simple 4 parsed_4gat 1
1 4gat.mr . . n/a 14 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 15 distance "hydrogen bond" simple 8 parsed_4gat 1
1 4gat.mr . . n/a 16 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 17 distance "general distance" ambi 2 parsed_4gat 1
1 4gat.mr . . n/a 18 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 19 "dihedral angle" "Not applicable" "Not applicable" 122 parsed_4gat 1
1 4gat.mr . . n/a 20 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 21 "dihedral angle" "Not applicable" "Not applicable" 170 parsed_4gat 1
1 4gat.mr . . n/a 22 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 23 "coupling constant" "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . n/a 24 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 25 "chemical shift" "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . n/a 26 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . XPLOR/CNS 27 "dipolar coupling" "Not applicable" "Not applicable" 48 parsed_4gat 1
1 4gat.mr . . n/a 28 comment "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . PIPP 29 "chemical shift" "Not applicable" "Not applicable" 0 parsed_4gat 1
1 4gat.mr . . "MR format" 30 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_4gat 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_27
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_4gat
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 27
_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 . . . . . . . . . . . . . . . . -0.77756 . . . . . 14 . N . 14 . HN parsed_4gat 1
2 . . . . . . . . . . . . . . . . -1.20895 . . . . . 38 . N . 38 . HN parsed_4gat 1
3 . . . . . . . . . . . . . . . . -0.52257 . . . . . 35 . N . 35 . HN parsed_4gat 1
4 . . . . . . . . . . . . . . . . -0.85773 . . . . . 50 . N . 50 . HN parsed_4gat 1
5 . . . . . . . . . . . . . . . . -0.93012 . . . . . 57 . N . 57 . HN parsed_4gat 1
6 . . . . . . . . . . . . . . . . -0.81479 . . . . . 37 . N . 37 . HN parsed_4gat 1
7 . . . . . . . . . . . . . . . . -0.67739 . . . . . 49 . N . 49 . HN parsed_4gat 1
8 . . . . . . . . . . . . . . . . -0.71234 . . . . . 42 . N . 42 . HN parsed_4gat 1
9 . . . . . . . . . . . . . . . . -0.55020 . . . . . 41 . N . 41 . HN parsed_4gat 1
10 . . . . . . . . . . . . . . . . -0.83144 . . . . . 45 . N . 45 . HN parsed_4gat 1
11 . . . . . . . . . . . . . . . . -0.80335 . . . . . 46 . N . 46 . HN parsed_4gat 1
12 . . . . . . . . . . . . . . . . -0.31037 . . . . . 39 . N . 39 . HN parsed_4gat 1
13 . . . . . . . . . . . . . . . . -0.32426 . . . . . 40 . N . 40 . HN parsed_4gat 1
14 . . . . . . . . . . . . . . . . -0.63992 . . . . . 52 . N . 52 . HN parsed_4gat 1
15 . . . . . . . . . . . . . . . . -0.48737 . . . . . 36 . N . 36 . HN parsed_4gat 1
16 . . . . . . . . . . . . . . . . -0.50211 . . . . . 25 . N . 25 . HN parsed_4gat 1
17 . . . . . . . . . . . . . . . . -0.33751 . . . . . 56 . N . 56 . HN parsed_4gat 1
18 . . . . . . . . . . . . . . . . -0.30286 . . . . . 58 . N . 58 . HN parsed_4gat 1
19 . . . . . . . . . . . . . . . . -0.15434 . . . . . 43 . N . 43 . HN parsed_4gat 1
20 . . . . . . . . . . . . . . . . -0.37246 . . . . . 12 . N . 12 . HN parsed_4gat 1
21 . . . . . . . . . . . . . . . . -0.35145 . . . . . 10 . N . 10 . HN parsed_4gat 1
22 . . . . . . . . . . . . . . . . -0.38367 . . . . . 51 . N . 51 . HN parsed_4gat 1
23 . . . . . . . . . . . . . . . . 0.35575 . . . . . 33 . N . 33 . HN parsed_4gat 1
24 . . . . . . . . . . . . . . . . -0.09715 . . . . . 24 . N . 24 . HN parsed_4gat 1
25 . . . . . . . . . . . . . . . . -0.28261 . . . . . 17 . N . 17 . HN parsed_4gat 1
26 . . . . . . . . . . . . . . . . 0.06622 . . . . . 18 . N . 18 . HN parsed_4gat 1
27 . . . . . . . . . . . . . . . . -0.44252 . . . . . 13 . N . 13 . HN parsed_4gat 1
28 . . . . . . . . . . . . . . . . -0.36771 . . . . . 32 . N . 32 . HN parsed_4gat 1
29 . . . . . . . . . . . . . . . . -0.20344 . . . . . 8 . N . 8 . HN parsed_4gat 1
30 . . . . . . . . . . . . . . . . -0.13198 . . . . . 44 . N . 44 . HN parsed_4gat 1
31 . . . . . . . . . . . . . . . . -0.08107 . . . . . 5 . N . 5 . HN parsed_4gat 1
32 . . . . . . . . . . . . . . . . 0.11027 . . . . . 30 . N . 30 . HN parsed_4gat 1
33 . . . . . . . . . . . . . . . . -0.06358 . . . . . 16 . N . 16 . HN parsed_4gat 1
34 . . . . . . . . . . . . . . . . -0.14924 . . . . . 6 . N . 6 . HN parsed_4gat 1
35 . . . . . . . . . . . . . . . . -0.19471 . . . . . 7 . N . 7 . HN parsed_4gat 1
36 . . . . . . . . . . . . . . . . -0.00748 . . . . . 55 . N . 55 . HN parsed_4gat 1
37 . . . . . . . . . . . . . . . . -0.10258 . . . . . 61 . N . 61 . HN parsed_4gat 1
38 . . . . . . . . . . . . . . . . 0.23914 . . . . . 22 . N . 22 . HN parsed_4gat 1
39 . . . . . . . . . . . . . . . . 0.42294 . . . . . 53 . N . 53 . HN parsed_4gat 1
40 . . . . . . . . . . . . . . . . 0.02811 . . . . . 23 . N . 23 . HN parsed_4gat 1
41 . . . . . . . . . . . . . . . . 0.41193 . . . . . 54 . N . 54 . HN parsed_4gat 1
42 . . . . . . . . . . . . . . . . 0.14938 . . . . . 15 . N . 15 . HN parsed_4gat 1
43 . . . . . . . . . . . . . . . . 0.59917 . . . . . 28 . N . 28 . HN parsed_4gat 1
44 . . . . . . . . . . . . . . . . 0.52378 . . . . . 20 . N . 20 . HN parsed_4gat 1
45 . . . . . . . . . . . . . . . . 0.39185 . . . . . 29 . N . 29 . HN parsed_4gat 1
46 . . . . . . . . . . . . . . . . 1.01086 . . . . . 60 . N . 60 . HN parsed_4gat 1
47 . . . . . . . . . . . . . . . . 0.92725 . . . . . 47 . N . 47 . HN parsed_4gat 1
48 . . . . . . . . . . . . . . . . 1.12876 . . . . . 59 . N . 59 . HN parsed_4gat 1
stop_
save_
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