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 |
|
|
637761 |
6gms   |
18823 | cing | 2-parsed | STAR | dipolar coupling | 45 |
data_6gms_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6gms
_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_6gms 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6gms
_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 6gms "Master copy" parsed_6gms
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6gms
_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 6gms.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6gms 1
1 6gms.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 45 parsed_6gms 1
1 6gms.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 0 parsed_6gms 1
1 6gms.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_6gms 1
1 6gms.mr . . XPLOR/CNS 5 distance NOE ambi 0 parsed_6gms 1
1 6gms.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6gms 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_2
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_6gms
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 2
_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 . . . . . . . . . . . . . . . . 6.387 . . . . . 28 . HN . 28 . N parsed_6gms 1
2 . . . . . . . . . . . . . . . . 28.612 . . . . . 31 . HN . 31 . N parsed_6gms 1
3 . . . . . . . . . . . . . . . . 7.854 . . . . . 35 . HN . 35 . N parsed_6gms 1
4 . . . . . . . . . . . . . . . . 13.229 . . . . . 43 . HN . 43 . N parsed_6gms 1
5 . . . . . . . . . . . . . . . . 35.839 . . . . . 45 . HN . 45 . N parsed_6gms 1
6 . . . . . . . . . . . . . . . . 37.767 . . . . . 47 . HN . 47 . N parsed_6gms 1
7 . . . . . . . . . . . . . . . . 23.229 . . . . . 51 . HN . 51 . N parsed_6gms 1
8 . . . . . . . . . . . . . . . . 26.556 . . . . . 54 . HN . 54 . N parsed_6gms 1
9 . . . . . . . . . . . . . . . . 16.541 . . . . . 55 . HN . 55 . N parsed_6gms 1
10 . . . . . . . . . . . . . . . . 21.379 . . . . . 56 . HN . 56 . N parsed_6gms 1
11 . . . . . . . . . . . . . . . . -36.502 . . . . . 59 . HN . 59 . N parsed_6gms 1
12 . . . . . . . . . . . . . . . . 13.451 . . . . . 61 . HN . 61 . N parsed_6gms 1
13 . . . . . . . . . . . . . . . . 9.239 . . . . . 65 . HN . 65 . N parsed_6gms 1
14 . . . . . . . . . . . . . . . . 0.867 . . . . . 69 . HN . 69 . N parsed_6gms 1
15 . . . . . . . . . . . . . . . . -25.961 . . . . . 71 . HN . 71 . N parsed_6gms 1
16 . . . . . . . . . . . . . . . . -15.183 . . . . . 72 . HN . 72 . N parsed_6gms 1
17 . . . . . . . . . . . . . . . . -13.573 . . . . . 73 . HN . 73 . N parsed_6gms 1
18 . . . . . . . . . . . . . . . . -18.585 . . . . . 75 . HN . 75 . N parsed_6gms 1
19 . . . . . . . . . . . . . . . . -7.364 . . . . . 80 . HN . 80 . N parsed_6gms 1
20 . . . . . . . . . . . . . . . . -13.097 . . . . . 81 . HN . 81 . N parsed_6gms 1
21 . . . . . . . . . . . . . . . . 1.138 . . . . . 82 . HN . 82 . N parsed_6gms 1
22 . . . . . . . . . . . . . . . . -13.755 . . . . . 83 . HN . 83 . N parsed_6gms 1
23 . . . . . . . . . . . . . . . . -17.693 . . . . . 84 . HN . 84 . N parsed_6gms 1
24 . . . . . . . . . . . . . . . . 33.730 . . . . . 85 . HN . 85 . N parsed_6gms 1
25 . . . . . . . . . . . . . . . . -7.292 . . . . . 86 . HN . 86 . N parsed_6gms 1
26 . . . . . . . . . . . . . . . . 12.286 . . . . . 87 . HN . 87 . N parsed_6gms 1
27 . . . . . . . . . . . . . . . . -14.314 . . . . . 88 . HN . 88 . N parsed_6gms 1
28 . . . . . . . . . . . . . . . . 0.666 . . . . . 90 . HN . 90 . N parsed_6gms 1
29 . . . . . . . . . . . . . . . . 29.588 . . . . . 95 . HN . 95 . N parsed_6gms 1
30 . . . . . . . . . . . . . . . . -3.360 . . . . . 96 . HN . 96 . N parsed_6gms 1
31 . . . . . . . . . . . . . . . . -5.176 . . . . . 100 . HN . 100 . N parsed_6gms 1
32 . . . . . . . . . . . . . . . . -19.499 . . . . . 101 . HN . 101 . N parsed_6gms 1
33 . . . . . . . . . . . . . . . . 15.316 . . . . . 104 . HN . 104 . N parsed_6gms 1
34 . . . . . . . . . . . . . . . . 24.267 . . . . . 110 . HN . 110 . N parsed_6gms 1
35 . . . . . . . . . . . . . . . . -18.770 . . . . . 116 . HN . 116 . N parsed_6gms 1
36 . . . . . . . . . . . . . . . . -9.188 . . . . . 121 . HN . 121 . N parsed_6gms 1
37 . . . . . . . . . . . . . . . . -1.914 . . . . . 122 . HN . 122 . N parsed_6gms 1
38 . . . . . . . . . . . . . . . . 16.503 . . . . . 135 . HN . 135 . N parsed_6gms 1
39 . . . . . . . . . . . . . . . . 7.156 . . . . . 136 . HN . 136 . N parsed_6gms 1
40 . . . . . . . . . . . . . . . . -1.285 . . . . . 137 . HN . 137 . N parsed_6gms 1
41 . . . . . . . . . . . . . . . . 6.037 . . . . . 142 . HN . 142 . N parsed_6gms 1
42 . . . . . . . . . . . . . . . . 2.567 . . . . . 145 . HN . 145 . N parsed_6gms 1
43 . . . . . . . . . . . . . . . . -7.863 . . . . . 146 . HN . 146 . N parsed_6gms 1
44 . . . . . . . . . . . . . . . . -3.133 . . . . . 147 . HN . 147 . N parsed_6gms 1
45 . . . . . . . . . . . . . . . . 5.225 . . . . . 151 . HN . 151 . N parsed_6gms 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 "# Restraints file 1: rdc.tbl" 1 1 1 28 parsed_6gms 1
stop_
save_
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