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 |
|
|
533435 |
2kw6   |
16808 | cing | 2-parsed | STAR | dipolar coupling | 40 |
data_2kw6_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2kw6
_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_2kw6 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2kw6
_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 2kw6 "Master copy" parsed_2kw6
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2kw6
_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 2kw6.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2kw6 1
1 2kw6.mr . . XPLOR/CNS 2 distance NOE simple 1901 parsed_2kw6 1
1 2kw6.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 182 parsed_2kw6 1
1 2kw6.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 72 parsed_2kw6 1
1 2kw6.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 40 parsed_2kw6 1
1 2kw6.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2kw6 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2kw6
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 5
_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 . . . . . . . . . . . . . . . . -18.9591 . . . . . 65 . N . 64 . C parsed_2kw6 1
2 . . . . . . . . . . . . . . . . 2.3407 . . . . . 66 . N . 65 . C parsed_2kw6 1
3 . . . . . . . . . . . . . . . . -6.6140 . . . . . 68 . N . 67 . C parsed_2kw6 1
4 . . . . . . . . . . . . . . . . -11.3038 . . . . . 69 . N . 68 . C parsed_2kw6 1
5 . . . . . . . . . . . . . . . . -14.6858 . . . . . 72 . N . 71 . C parsed_2kw6 1
6 . . . . . . . . . . . . . . . . -11.7620 . . . . . 73 . N . 72 . C parsed_2kw6 1
7 . . . . . . . . . . . . . . . . -10.5125 . . . . . 74 . N . 73 . C parsed_2kw6 1
8 . . . . . . . . . . . . . . . . -4.2066 . . . . . 75 . N . 74 . C parsed_2kw6 1
9 . . . . . . . . . . . . . . . . -19.0257 . . . . . 76 . N . 75 . C parsed_2kw6 1
10 . . . . . . . . . . . . . . . . -7.7636 . . . . . 77 . N . 76 . C parsed_2kw6 1
11 . . . . . . . . . . . . . . . . -16.1602 . . . . . 78 . N . 77 . C parsed_2kw6 1
12 . . . . . . . . . . . . . . . . 9.6711 . . . . . 80 . N . 79 . C parsed_2kw6 1
13 . . . . . . . . . . . . . . . . -10.9206 . . . . . 81 . N . 80 . C parsed_2kw6 1
14 . . . . . . . . . . . . . . . . -9.5129 . . . . . 83 . N . 82 . C parsed_2kw6 1
15 . . . . . . . . . . . . . . . . 11.6370 . . . . . 84 . N . 83 . C parsed_2kw6 1
16 . . . . . . . . . . . . . . . . -6.6557 . . . . . 85 . N . 84 . C parsed_2kw6 1
17 . . . . . . . . . . . . . . . . -12.1618 . . . . . 86 . N . 85 . C parsed_2kw6 1
18 . . . . . . . . . . . . . . . . -10.1709 . . . . . 87 . N . 86 . C parsed_2kw6 1
19 . . . . . . . . . . . . . . . . 0.9080 . . . . . 88 . N . 87 . C parsed_2kw6 1
20 . . . . . . . . . . . . . . . . 2.3990 . . . . . 91 . N . 90 . C parsed_2kw6 1
21 . . . . . . . . . . . . . . . . -5.6644 . . . . . 92 . N . 91 . C parsed_2kw6 1
22 . . . . . . . . . . . . . . . . -6.0976 . . . . . 93 . N . 92 . C parsed_2kw6 1
23 . . . . . . . . . . . . . . . . -15.9186 . . . . . 94 . N . 93 . C parsed_2kw6 1
24 . . . . . . . . . . . . . . . . 5.9310 . . . . . 95 . N . 94 . C parsed_2kw6 1
25 . . . . . . . . . . . . . . . . -5.2979 . . . . . 97 . N . 96 . C parsed_2kw6 1
26 . . . . . . . . . . . . . . . . -7.9635 . . . . . 98 . N . 97 . C parsed_2kw6 1
27 . . . . . . . . . . . . . . . . -5.0230 . . . . . 99 . N . 98 . C parsed_2kw6 1
28 . . . . . . . . . . . . . . . . -3.8984 . . . . . 100 . N . 99 . C parsed_2kw6 1
29 . . . . . . . . . . . . . . . . -17.8845 . . . . . 101 . N . 100 . C parsed_2kw6 1
30 . . . . . . . . . . . . . . . . 3.5403 . . . . . 102 . N . 101 . C parsed_2kw6 1
31 . . . . . . . . . . . . . . . . -8.8381 . . . . . 103 . N . 102 . C parsed_2kw6 1
32 . . . . . . . . . . . . . . . . -1.0746 . . . . . 106 . N . 105 . C parsed_2kw6 1
33 . . . . . . . . . . . . . . . . -8.7298 . . . . . 107 . N . 106 . C parsed_2kw6 1
34 . . . . . . . . . . . . . . . . -11.5537 . . . . . 108 . N . 107 . C parsed_2kw6 1
35 . . . . . . . . . . . . . . . . -1.1579 . . . . . 109 . N . 108 . C parsed_2kw6 1
36 . . . . . . . . . . . . . . . . -8.5133 . . . . . 110 . N . 109 . C parsed_2kw6 1
37 . . . . . . . . . . . . . . . . -3.3070 . . . . . 111 . N . 110 . C parsed_2kw6 1
38 . . . . . . . . . . . . . . . . 0.1333 . . . . . 113 . N . 112 . C parsed_2kw6 1
39 . . . . . . . . . . . . . . . . -4.2316 . . . . . 114 . N . 113 . C parsed_2kw6 1
40 . . . . . . . . . . . . . . . . 0.0250 . . . . . 115 . N . 114 . C parsed_2kw6 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 "# NCO-RDC constraints" 1 1 1 21 parsed_2kw6 1
stop_
save_
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