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 |
|
|
36491 |
1nnv   |
5779 | cing | 2-parsed | STAR | dipolar coupling | 66 |
data_1nnv_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1nnv
_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_1nnv 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1nnv
_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 1nnv "Master copy" parsed_1nnv
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1nnv
_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 1nnv.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1nnv 1
1 1nnv.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1nnv 1
1 1nnv.mr . . XPLOR/CNS 3 distance NOE ambi 658 parsed_1nnv 1
1 1nnv.mr . . XPLOR/CNS 4 distance NOE ambi 2049 parsed_1nnv 1
1 1nnv.mr . . XPLOR/CNS 5 distance NOE ambi 835 parsed_1nnv 1
1 1nnv.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 66 parsed_1nnv 1
1 1nnv.mr . . XPLOR/CNS 7 distance "hydrogen bond" simple 0 parsed_1nnv 1
1 1nnv.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1nnv 1
1 1nnv.mr . . "MR format" 9 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1nnv 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_6
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_1nnv
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . 3.27 . . . . . 3 . N . 3 . HN parsed_1nnv 1
2 . . . . . . . . . . . . . . . . -0.83 . . . . . 4 . N . 4 . HN parsed_1nnv 1
3 . . . . . . . . . . . . . . . . -1.32 . . . . . 8 . N . 8 . HN parsed_1nnv 1
4 . . . . . . . . . . . . . . . . -0.31 . . . . . 9 . N . 9 . HN parsed_1nnv 1
5 . . . . . . . . . . . . . . . . -9.55 . . . . . 11 . N . 11 . HN parsed_1nnv 1
6 . . . . . . . . . . . . . . . . -5.12 . . . . . 13 . N . 13 . HN parsed_1nnv 1
7 . . . . . . . . . . . . . . . . -7.39 . . . . . 14 . N . 14 . HN parsed_1nnv 1
8 . . . . . . . . . . . . . . . . -7.91 . . . . . 15 . N . 15 . HN parsed_1nnv 1
9 . . . . . . . . . . . . . . . . -6.1 . . . . . 16 . N . 16 . HN parsed_1nnv 1
10 . . . . . . . . . . . . . . . . -6.68 . . . . . 17 . N . 17 . HN parsed_1nnv 1
11 . . . . . . . . . . . . . . . . -9.21 . . . . . 19 . N . 19 . HN parsed_1nnv 1
12 . . . . . . . . . . . . . . . . -6.22 . . . . . 20 . N . 20 . HN parsed_1nnv 1
13 . . . . . . . . . . . . . . . . -5.7 . . . . . 21 . N . 21 . HN parsed_1nnv 1
14 . . . . . . . . . . . . . . . . -5.07 . . . . . 23 . N . 23 . HN parsed_1nnv 1
15 . . . . . . . . . . . . . . . . -6.62 . . . . . 24 . N . 24 . HN parsed_1nnv 1
16 . . . . . . . . . . . . . . . . -7.54 . . . . . 25 . N . 25 . HN parsed_1nnv 1
17 . . . . . . . . . . . . . . . . -2.56 . . . . . 27 . N . 27 . HN parsed_1nnv 1
18 . . . . . . . . . . . . . . . . -1.66 . . . . . 28 . N . 28 . HN parsed_1nnv 1
19 . . . . . . . . . . . . . . . . -2.3 . . . . . 30 . N . 30 . HN parsed_1nnv 1
20 . . . . . . . . . . . . . . . . 2.53 . . . . . 32 . N . 32 . HN parsed_1nnv 1
21 . . . . . . . . . . . . . . . . 5.84 . . . . . 33 . N . 33 . HN parsed_1nnv 1
22 . . . . . . . . . . . . . . . . -4.11 . . . . . 34 . N . 34 . HN parsed_1nnv 1
23 . . . . . . . . . . . . . . . . 2.28 . . . . . 36 . N . 36 . HN parsed_1nnv 1
24 . . . . . . . . . . . . . . . . 1.54 . . . . . 37 . N . 37 . HN parsed_1nnv 1
25 . . . . . . . . . . . . . . . . -8.2 . . . . . 42 . N . 42 . HN parsed_1nnv 1
26 . . . . . . . . . . . . . . . . -7.17 . . . . . 43 . N . 43 . HN parsed_1nnv 1
27 . . . . . . . . . . . . . . . . 3.22 . . . . . 45 . N . 45 . HN parsed_1nnv 1
28 . . . . . . . . . . . . . . . . -4.46 . . . . . 46 . N . 46 . HN parsed_1nnv 1
29 . . . . . . . . . . . . . . . . -3.08 . . . . . 47 . N . 47 . HN parsed_1nnv 1
30 . . . . . . . . . . . . . . . . 1.26 . . . . . 49 . N . 49 . HN parsed_1nnv 1
31 . . . . . . . . . . . . . . . . 0.17 . . . . . 51 . N . 51 . HN parsed_1nnv 1
32 . . . . . . . . . . . . . . . . -2.12 . . . . . 53 . N . 53 . HN parsed_1nnv 1
33 . . . . . . . . . . . . . . . . 2.12 . . . . . 55 . N . 55 . HN parsed_1nnv 1
34 . . . . . . . . . . . . . . . . -6.07 . . . . . 57 . N . 57 . HN parsed_1nnv 1
35 . . . . . . . . . . . . . . . . -8.87 . . . . . 59 . N . 59 . HN parsed_1nnv 1
36 . . . . . . . . . . . . . . . . -6.97 . . . . . 60 . N . 60 . HN parsed_1nnv 1
37 . . . . . . . . . . . . . . . . 0.1 . . . . . 62 . N . 62 . HN parsed_1nnv 1
38 . . . . . . . . . . . . . . . . 7.48 . . . . . 63 . N . 63 . HN parsed_1nnv 1
39 . . . . . . . . . . . . . . . . -1.31 . . . . . 64 . N . 64 . HN parsed_1nnv 1
40 . . . . . . . . . . . . . . . . 0.96 . . . . . 65 . N . 65 . HN parsed_1nnv 1
41 . . . . . . . . . . . . . . . . -1.06 . . . . . 69 . N . 69 . HN parsed_1nnv 1
42 . . . . . . . . . . . . . . . . 0.67 . . . . . 70 . N . 70 . HN parsed_1nnv 1
43 . . . . . . . . . . . . . . . . -5.76 . . . . . 71 . N . 71 . HN parsed_1nnv 1
44 . . . . . . . . . . . . . . . . -3.68 . . . . . 73 . N . 73 . HN parsed_1nnv 1
45 . . . . . . . . . . . . . . . . 0.33 . . . . . 74 . N . 74 . HN parsed_1nnv 1
46 . . . . . . . . . . . . . . . . -7.79 . . . . . 75 . N . 75 . HN parsed_1nnv 1
47 . . . . . . . . . . . . . . . . 4.64 . . . . . 77 . N . 77 . HN parsed_1nnv 1
48 . . . . . . . . . . . . . . . . -3.33 . . . . . 81 . N . 81 . HN parsed_1nnv 1
49 . . . . . . . . . . . . . . . . -1.66 . . . . . 83 . N . 83 . HN parsed_1nnv 1
50 . . . . . . . . . . . . . . . . -2.74 . . . . . 85 . N . 85 . HN parsed_1nnv 1
51 . . . . . . . . . . . . . . . . -0.68 . . . . . 88 . N . 88 . HN parsed_1nnv 1
52 . . . . . . . . . . . . . . . . 1.66 . . . . . 89 . N . 89 . HN parsed_1nnv 1
53 . . . . . . . . . . . . . . . . 1.06 . . . . . 90 . N . 90 . HN parsed_1nnv 1
54 . . . . . . . . . . . . . . . . -4.21 . . . . . 91 . N . 91 . HN parsed_1nnv 1
55 . . . . . . . . . . . . . . . . -0.64 . . . . . 92 . N . 92 . HN parsed_1nnv 1
56 . . . . . . . . . . . . . . . . -4.92 . . . . . 93 . N . 93 . HN parsed_1nnv 1
57 . . . . . . . . . . . . . . . . 0.06 . . . . . 94 . N . 94 . HN parsed_1nnv 1
58 . . . . . . . . . . . . . . . . -4.92 . . . . . 97 . N . 97 . HN parsed_1nnv 1
59 . . . . . . . . . . . . . . . . 0.14 . . . . . 98 . N . 98 . HN parsed_1nnv 1
60 . . . . . . . . . . . . . . . . -3.92 . . . . . 99 . N . 99 . HN parsed_1nnv 1
61 . . . . . . . . . . . . . . . . -5.64 . . . . . 100 . N . 100 . HN parsed_1nnv 1
62 . . . . . . . . . . . . . . . . -1.64 . . . . . 101 . N . 101 . HN parsed_1nnv 1
63 . . . . . . . . . . . . . . . . -2.98 . . . . . 102 . N . 102 . HN parsed_1nnv 1
64 . . . . . . . . . . . . . . . . 0.42 . . . . . 103 . N . 103 . HN parsed_1nnv 1
65 . . . . . . . . . . . . . . . . -3.27 . . . . . 104 . N . 104 . HN parsed_1nnv 1
66 . . . . . . . . . . . . . . . . -1.86 . . . . . 107 . N . 107 . HN parsed_1nnv 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
;
made by NOEID
used DIPOCOUP to determined which residues to comment out
;
1 1 2 60 parsed_1nnv 1
stop_
save_
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