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 |
|
|
645711 |
6pvr   |
30645 | cing | 2-parsed | STAR | dipolar coupling | 92 |
data_6pvr_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6pvr
_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_6pvr 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6pvr
_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 6pvr "Master copy" parsed_6pvr
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6pvr
_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 6pvr.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6pvr 1
1 6pvr.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 200 parsed_6pvr 1
1 6pvr.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 152 parsed_6pvr 1
1 6pvr.mr . . XPLOR/CNS 4 distance NOE simple 0 parsed_6pvr 1
1 6pvr.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 92 parsed_6pvr 1
1 6pvr.mr . . XPLOR/CNS 6 distance NOE ambi 0 parsed_6pvr 1
1 6pvr.mr . . "MR format" 7 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6pvr 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_6pvr
_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 . . . . . . . . . . . . . . . . 8.9 8.4 9.4 . . A 6 . N A 6 . HN parsed_6pvr 1
2 . . . . . . . . . . . . . . . . 7.2 6.5 7.9 . . A 7 . N A 7 . HN parsed_6pvr 1
3 . . . . . . . . . . . . . . . . 8.9 8.4 9.4 . . A 8 . N A 8 . HN parsed_6pvr 1
4 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . A 9 . N A 9 . HN parsed_6pvr 1
5 . . . . . . . . . . . . . . . . 7.7 7.2 8.2 . . A 10 . N A 10 . HN parsed_6pvr 1
6 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . A 11 . N A 11 . HN parsed_6pvr 1
7 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . A 12 . N A 12 . HN parsed_6pvr 1
8 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . A 13 . N A 13 . HN parsed_6pvr 1
9 . . . . . . . . . . . . . . . . 6.9 6.4 7.4 . . A 14 . N A 14 . HN parsed_6pvr 1
10 . . . . . . . . . . . . . . . . 8.3 7.8 8.8 . . A 15 . N A 15 . HN parsed_6pvr 1
11 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . A 16 . N A 16 . HN parsed_6pvr 1
12 . . . . . . . . . . . . . . . . 7.5 7.0 8.0 . . A 17 . N A 17 . HN parsed_6pvr 1
13 . . . . . . . . . . . . . . . . 6.9 6.4 7.4 . . A 18 . N A 18 . HN parsed_6pvr 1
14 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . A 19 . N A 19 . HN parsed_6pvr 1
15 . . . . . . . . . . . . . . . . 9.9 9.4 10.4 . . A 20 . N A 20 . HN parsed_6pvr 1
16 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . A 21 . N A 21 . HN parsed_6pvr 1
17 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . A 22 . N A 22 . HN parsed_6pvr 1
18 . . . . . . . . . . . . . . . . 10.3 9.8 10.8 . . A 23 . N A 23 . HN parsed_6pvr 1
19 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . A 24 . N A 24 . HN parsed_6pvr 1
20 . . . . . . . . . . . . . . . . 7.2 6.5 7.9 . . A 25 . N A 25 . HN parsed_6pvr 1
21 . . . . . . . . . . . . . . . . 10.1 9.1 11.1 . . A 26 . N A 26 . HN parsed_6pvr 1
22 . . . . . . . . . . . . . . . . 10.3 9.8 10.8 . . A 27 . N A 27 . HN parsed_6pvr 1
23 . . . . . . . . . . . . . . . . 7.7 7.2 8.2 . . A 28 . N A 28 . HN parsed_6pvr 1
24 . . . . . . . . . . . . . . . . 8.9 8.4 9.4 . . B 6 . N B 6 . HN parsed_6pvr 1
25 . . . . . . . . . . . . . . . . 7.2 6.5 7.9 . . B 7 . N B 7 . HN parsed_6pvr 1
26 . . . . . . . . . . . . . . . . 8.9 8.4 9.4 . . B 8 . N B 8 . HN parsed_6pvr 1
27 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . B 9 . N B 9 . HN parsed_6pvr 1
28 . . . . . . . . . . . . . . . . 7.7 7.2 8.2 . . B 10 . N B 10 . HN parsed_6pvr 1
29 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . B 11 . N B 11 . HN parsed_6pvr 1
30 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . B 12 . N B 12 . HN parsed_6pvr 1
31 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . B 13 . N B 13 . HN parsed_6pvr 1
32 . . . . . . . . . . . . . . . . 6.9 6.4 7.4 . . B 14 . N B 14 . HN parsed_6pvr 1
33 . . . . . . . . . . . . . . . . 8.3 7.8 8.8 . . B 15 . N B 15 . HN parsed_6pvr 1
34 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . B 16 . N B 16 . HN parsed_6pvr 1
35 . . . . . . . . . . . . . . . . 7.5 7.0 8.0 . . B 17 . N B 17 . HN parsed_6pvr 1
36 . . . . . . . . . . . . . . . . 6.9 6.4 7.4 . . B 18 . N B 18 . HN parsed_6pvr 1
37 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . B 19 . N B 19 . HN parsed_6pvr 1
38 . . . . . . . . . . . . . . . . 9.9 9.4 10.4 . . B 20 . N B 20 . HN parsed_6pvr 1
39 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . B 21 . N B 21 . HN parsed_6pvr 1
40 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . B 22 . N B 22 . HN parsed_6pvr 1
41 . . . . . . . . . . . . . . . . 10.3 9.8 10.8 . . B 23 . N B 23 . HN parsed_6pvr 1
42 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . B 24 . N B 24 . HN parsed_6pvr 1
43 . . . . . . . . . . . . . . . . 7.2 6.5 7.9 . . B 25 . N B 25 . HN parsed_6pvr 1
44 . . . . . . . . . . . . . . . . 10.1 9.1 11.1 . . B 26 . N B 26 . HN parsed_6pvr 1
45 . . . . . . . . . . . . . . . . 10.3 9.8 10.8 . . B 27 . N B 27 . HN parsed_6pvr 1
46 . . . . . . . . . . . . . . . . 7.7 7.2 8.2 . . B 28 . N B 28 . HN parsed_6pvr 1
47 . . . . . . . . . . . . . . . . 8.9 8.4 9.4 . . C 6 . N C 6 . HN parsed_6pvr 1
48 . . . . . . . . . . . . . . . . 7.2 6.5 7.9 . . C 7 . N C 7 . HN parsed_6pvr 1
49 . . . . . . . . . . . . . . . . 8.9 8.4 9.4 . . C 8 . N C 8 . HN parsed_6pvr 1
50 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . C 9 . N C 9 . HN parsed_6pvr 1
51 . . . . . . . . . . . . . . . . 7.7 7.2 8.2 . . C 10 . N C 10 . HN parsed_6pvr 1
52 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . C 11 . N C 11 . HN parsed_6pvr 1
53 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . C 12 . N C 12 . HN parsed_6pvr 1
54 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . C 13 . N C 13 . HN parsed_6pvr 1
55 . . . . . . . . . . . . . . . . 6.9 6.4 7.4 . . C 14 . N C 14 . HN parsed_6pvr 1
56 . . . . . . . . . . . . . . . . 8.3 7.8 8.8 . . C 15 . N C 15 . HN parsed_6pvr 1
57 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . C 16 . N C 16 . HN parsed_6pvr 1
58 . . . . . . . . . . . . . . . . 7.5 7.0 8.0 . . C 17 . N C 17 . HN parsed_6pvr 1
59 . . . . . . . . . . . . . . . . 6.9 6.4 7.4 . . C 18 . N C 18 . HN parsed_6pvr 1
60 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . C 19 . N C 19 . HN parsed_6pvr 1
61 . . . . . . . . . . . . . . . . 9.9 9.4 10.4 . . C 20 . N C 20 . HN parsed_6pvr 1
62 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . C 21 . N C 21 . HN parsed_6pvr 1
63 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . C 22 . N C 22 . HN parsed_6pvr 1
64 . . . . . . . . . . . . . . . . 10.3 9.8 10.8 . . C 23 . N C 23 . HN parsed_6pvr 1
65 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . C 24 . N C 24 . HN parsed_6pvr 1
66 . . . . . . . . . . . . . . . . 7.2 6.5 7.9 . . C 25 . N C 25 . HN parsed_6pvr 1
67 . . . . . . . . . . . . . . . . 10.1 9.1 11.1 . . C 26 . N C 26 . HN parsed_6pvr 1
68 . . . . . . . . . . . . . . . . 10.3 9.8 10.8 . . C 27 . N C 27 . HN parsed_6pvr 1
69 . . . . . . . . . . . . . . . . 7.7 7.2 8.2 . . C 28 . N C 28 . HN parsed_6pvr 1
70 . . . . . . . . . . . . . . . . 8.9 8.4 9.4 . . D 6 . N D 6 . HN parsed_6pvr 1
71 . . . . . . . . . . . . . . . . 7.2 6.5 7.9 . . D 7 . N D 7 . HN parsed_6pvr 1
72 . . . . . . . . . . . . . . . . 8.9 8.4 9.4 . . D 8 . N D 8 . HN parsed_6pvr 1
73 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . D 9 . N D 9 . HN parsed_6pvr 1
74 . . . . . . . . . . . . . . . . 7.7 7.2 8.2 . . D 10 . N D 10 . HN parsed_6pvr 1
75 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . D 11 . N D 11 . HN parsed_6pvr 1
76 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . D 12 . N D 12 . HN parsed_6pvr 1
77 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . D 13 . N D 13 . HN parsed_6pvr 1
78 . . . . . . . . . . . . . . . . 6.9 6.4 7.4 . . D 14 . N D 14 . HN parsed_6pvr 1
79 . . . . . . . . . . . . . . . . 8.3 7.8 8.8 . . D 15 . N D 15 . HN parsed_6pvr 1
80 . . . . . . . . . . . . . . . . 9.2 8.2 10.2 . . D 16 . N D 16 . HN parsed_6pvr 1
81 . . . . . . . . . . . . . . . . 7.5 7.0 8.0 . . D 17 . N D 17 . HN parsed_6pvr 1
82 . . . . . . . . . . . . . . . . 6.9 6.4 7.4 . . D 18 . N D 18 . HN parsed_6pvr 1
83 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . D 19 . N D 19 . HN parsed_6pvr 1
84 . . . . . . . . . . . . . . . . 9.9 9.4 10.4 . . D 20 . N D 20 . HN parsed_6pvr 1
85 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . D 21 . N D 21 . HN parsed_6pvr 1
86 . . . . . . . . . . . . . . . . 7.2 6.7 7.7 . . D 22 . N D 22 . HN parsed_6pvr 1
87 . . . . . . . . . . . . . . . . 10.3 9.8 10.8 . . D 23 . N D 23 . HN parsed_6pvr 1
88 . . . . . . . . . . . . . . . . 9.5 9.0 10.0 . . D 24 . N D 24 . HN parsed_6pvr 1
89 . . . . . . . . . . . . . . . . 7.2 6.5 7.9 . . D 25 . N D 25 . HN parsed_6pvr 1
90 . . . . . . . . . . . . . . . . 10.1 9.1 11.1 . . D 26 . N D 26 . HN parsed_6pvr 1
91 . . . . . . . . . . . . . . . . 10.3 9.8 10.8 . . D 27 . N D 27 . HN parsed_6pvr 1
92 . . . . . . . . . . . . . . . . 7.7 7.2 8.2 . . D 28 . N D 28 . HN parsed_6pvr 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
;
orientation restraints from uniaxial-rotation averaged NH DIpolar Couplings
=======================helix A
;
2 1 4 32 parsed_6pvr 1
2 "=======================helix B" 167 1 167 32 parsed_6pvr 1
3 "=======================helix C" 329 1 329 32 parsed_6pvr 1
4 "=======================helix D" 491 1 491 32 parsed_6pvr 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 8: rdc_all.tbl" 1 1 1 32 parsed_6pvr 1
stop_
save_
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