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 |
|
|
623723 |
6f0y   |
34201 | cing | 2-parsed | STAR | dipolar coupling | 61 |
data_6f0y_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6f0y
_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_6f0y 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6f0y
_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 6f0y "Master copy" parsed_6f0y
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6f0y
_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 6f0y.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6f0y 1
1 6f0y.mr . . XPLOR/CNS 2 "dipolar coupling" "Not applicable" "Not applicable" 61 parsed_6f0y 1
1 6f0y.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_6f0y 1
1 6f0y.mr . . XPLOR/CNS 4 distance NOE ambi 0 parsed_6f0y 1
1 6f0y.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 0 parsed_6f0y 1
1 6f0y.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6f0y 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_2
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_6f0y
_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 . . . . . . . . . . . . . . . . 4.5630 . . . . " F" 4 . HN " F" 4 . N parsed_6f0y 1
2 . . . . . . . . . . . . . . . . 8.9430 . . . . " F" 6 . HN " F" 6 . N parsed_6f0y 1
3 . . . . . . . . . . . . . . . . 5.6580 . . . . " F" 8 . HN " F" 8 . N parsed_6f0y 1
4 . . . . . . . . . . . . . . . . 7.4220 . . . . " F" 9 . HN " F" 9 . N parsed_6f0y 1
5 . . . . . . . . . . . . . . . . 6.0230 . . . . " F" 10 . HN " F" 10 . N parsed_6f0y 1
6 . . . . . . . . . . . . . . . . -2.1900 . . . . " F" 23 . HN " F" 23 . N parsed_6f0y 1
7 . . . . . . . . . . . . . . . . 4.4410 . . . . " F" 25 . HN " F" 25 . N parsed_6f0y 1
8 . . . . . . . . . . . . . . . . 13.1400 . . . . " F" 26 . HN " F" 26 . N parsed_6f0y 1
9 . . . . . . . . . . . . . . . . 13.2010 . . . . " F" 28 . HN " F" 28 . N parsed_6f0y 1
10 . . . . . . . . . . . . . . . . 9.6730 . . . . " F" 29 . HN " F" 29 . N parsed_6f0y 1
11 . . . . . . . . . . . . . . . . 3.4070 . . . . " F" 30 . HN " F" 30 . N parsed_6f0y 1
12 . . . . . . . . . . . . . . . . 15.3910 . . . . " F" 40 . HN " F" 40 . N parsed_6f0y 1
13 . . . . . . . . . . . . . . . . 10.2810 . . . . " F" 42 . HN " F" 42 . N parsed_6f0y 1
14 . . . . . . . . . . . . . . . . 5.7790 . . . . " F" 43 . HN " F" 43 . N parsed_6f0y 1
15 . . . . . . . . . . . . . . . . 4.3190 . . . . " F" 44 . HN " F" 44 . N parsed_6f0y 1
16 . . . . . . . . . . . . . . . . -2.7380 . . . . " F" 45 . HN " F" 45 . N parsed_6f0y 1
17 . . . . . . . . . . . . . . . . 0.3040 . . . . " F" 55 . HN " F" 55 . N parsed_6f0y 1
18 . . . . . . . . . . . . . . . . -3.4070 . . . . " F" 56 . HN " F" 56 . N parsed_6f0y 1
19 . . . . . . . . . . . . . . . . 6.6920 . . . . " F" 57 . HN " F" 57 . N parsed_6f0y 1
20 . . . . . . . . . . . . . . . . 7.1180 . . . . " F" 58 . HN " F" 58 . N parsed_6f0y 1
21 . . . . . . . . . . . . . . . . 12.2890 . . . . " F" 59 . HN " F" 59 . N parsed_6f0y 1
22 . . . . . . . . . . . . . . . . 13.6880 . . . . " F" 60 . HN " F" 60 . N parsed_6f0y 1
23 . . . . . . . . . . . . . . . . 10.8290 . . . . " F" 61 . HN " F" 61 . N parsed_6f0y 1
24 . . . . . . . . . . . . . . . . 7.4220 . . . . " F" 62 . HN " F" 62 . N parsed_6f0y 1
25 . . . . . . . . . . . . . . . . 0.6080 . . . . " F" 69 . HN " F" 69 . N parsed_6f0y 1
26 . . . . . . . . . . . . . . . . 11.2540 . . . . " F" 70 . HN " F" 70 . N parsed_6f0y 1
27 . . . . . . . . . . . . . . . . 10.7680 . . . . " F" 71 . HN " F" 71 . N parsed_6f0y 1
28 . . . . . . . . . . . . . . . . 13.8700 . . . . " F" 73 . HN " F" 73 . N parsed_6f0y 1
29 . . . . . . . . . . . . . . . . 6.9350 . . . . " F" 74 . HN " F" 74 . N parsed_6f0y 1
30 . . . . . . . . . . . . . . . . -0.1220 . . . . " F" 75 . HN " F" 75 . N parsed_6f0y 1
31 . . . . . . . . . . . . . . . . -1.2780 . . . . " F" 76 . HN " F" 76 . N parsed_6f0y 1
32 . . . . . . . . . . . . . . . . 0.8520 . . . . " F" 93 . HN " F" 93 . N parsed_6f0y 1
33 . . . . . . . . . . . . . . . . 0.9130 . . . . " F" 94 . HN " F" 94 . N parsed_6f0y 1
34 . . . . . . . . . . . . . . . . 2.4940 . . . . " F" 95 . HN " F" 95 . N parsed_6f0y 1
35 . . . . . . . . . . . . . . . . 10.0990 . . . . " F" 97 . HN " F" 97 . N parsed_6f0y 1
36 . . . . . . . . . . . . . . . . 10.2200 . . . . " F" 98 . HN " F" 98 . N parsed_6f0y 1
37 . . . . . . . . . . . . . . . . 10.2200 . . . . " F" 100 . HN " F" 100 . N parsed_6f0y 1
38 . . . . . . . . . . . . . . . . 1.4600 . . . . " F" 104 . HN " F" 104 . N parsed_6f0y 1
39 . . . . . . . . . . . . . . . . -0.9730 . . . . " F" 105 . HN " F" 105 . N parsed_6f0y 1
40 . . . . . . . . . . . . . . . . 11.5590 . . . . " F" 106 . HN " F" 106 . N parsed_6f0y 1
41 . . . . . . . . . . . . . . . . 8.8820 . . . . " F" 107 . HN " F" 107 . N parsed_6f0y 1
42 . . . . . . . . . . . . . . . . 11.6800 . . . . " F" 108 . HN " F" 108 . N parsed_6f0y 1
43 . . . . . . . . . . . . . . . . 13.8100 . . . . " F" 109 . HN " F" 109 . N parsed_6f0y 1
44 . . . . . . . . . . . . . . . . 7.1180 . . . . " F" 110 . HN " F" 110 . N parsed_6f0y 1
45 . . . . . . . . . . . . . . . . 2.3120 . . . . " F" 111 . HN " F" 111 . N parsed_6f0y 1
46 . . . . . . . . . . . . . . . . 0.8520 . . . . " F" 112 . HN " F" 112 . N parsed_6f0y 1
47 . . . . . . . . . . . . . . . . -0.7300 . . . . " F" 113 . HN " F" 113 . N parsed_6f0y 1
48 . . . . . . . . . . . . . . . . -0.1220 . . . . " F" 114 . HN " F" 114 . N parsed_6f0y 1
49 . . . . . . . . . . . . . . . . 8.9430 . . . . " F" 116 . HN " F" 116 . N parsed_6f0y 1
50 . . . . . . . . . . . . . . . . 9.5510 . . . . " F" 117 . HN " F" 117 . N parsed_6f0y 1
51 . . . . . . . . . . . . . . . . -0.6690 . . . . " F" 120 . HN " F" 120 . N parsed_6f0y 1
52 . . . . . . . . . . . . . . . . 6.8140 . . . . " F" 121 . HN " F" 121 . N parsed_6f0y 1
53 . . . . . . . . . . . . . . . . 0.9130 . . . . " F" 122 . HN " F" 122 . N parsed_6f0y 1
54 . . . . . . . . . . . . . . . . -0.1830 . . . . " F" 123 . HN " F" 123 . N parsed_6f0y 1
55 . . . . . . . . . . . . . . . . 7.1180 . . . . " F" 135 . HN " F" 135 . N parsed_6f0y 1
56 . . . . . . . . . . . . . . . . 6.6310 . . . . " F" 136 . HN " F" 136 . N parsed_6f0y 1
57 . . . . . . . . . . . . . . . . 12.1060 . . . . " F" 137 . HN " F" 137 . N parsed_6f0y 1
58 . . . . . . . . . . . . . . . . 9.2470 . . . . " F" 146 . HN " F" 146 . N parsed_6f0y 1
59 . . . . . . . . . . . . . . . . 14.1140 . . . . " F" 147 . HN " F" 147 . N parsed_6f0y 1
60 . . . . . . . . . . . . . . . . 14.2350 . . . . " F" 148 . HN " F" 148 . N parsed_6f0y 1
61 . . . . . . . . . . . . . . . . 14.6000 . . . . " F" 149 . HN " F" 149 . N parsed_6f0y 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: rdcs_1_4.tbl" 1 1 1 33 parsed_6f0y 1
stop_
save_
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