NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
515727 |
1vrv   |
cing | 2-parsed | STAR | dipolar coupling | 99 |
data_1vrv_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1vrv
_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_1vrv 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1vrv
_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 1vrv "Master copy" parsed_1vrv
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1vrv
_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 1vrv.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1vrv 1
1 1vrv.mr . . n/a 2 comment "Not applicable" "Not applicable" 0 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 3 distance NOE simple 83 parsed_1vrv 1
1 1vrv.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 21 parsed_1vrv 1
1 1vrv.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 7 distance "hydrogen bond" simple 12 parsed_1vrv 1
1 1vrv.mr . . n/a 8 comment "Not applicable" "Not applicable" 0 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 9 distance "hydrogen bond" simple 2 parsed_1vrv 1
1 1vrv.mr . . n/a 10 comment "Not applicable" "Not applicable" 0 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 11 "dipolar coupling" "Not applicable" "Not applicable" 75 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 12 "dipolar coupling" "Not applicable" "Not applicable" 59 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 13 "dipolar coupling" "Not applicable" "Not applicable" 58 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 14 "dipolar coupling" "Not applicable" "Not applicable" 99 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 15 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1vrv 1
1 1vrv.mr . . XPLOR/CNS 16 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_1vrv 1
1 1vrv.mr . . "MR format" 17 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1vrv 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_14
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_1vrv
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 14
_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 . . . . . . . . . . . . . . . . -2.5600 . . . . . 14 . N . 14 . HN parsed_1vrv 1
2 . . . . . . . . . . . . . . . . 5.5200 . . . . . 16 . N . 16 . HN parsed_1vrv 1
3 . . . . . . . . . . . . . . . . 9.8400 . . . . . 18 . N . 18 . HN parsed_1vrv 1
4 . . . . . . . . . . . . . . . . 10.2600 . . . . . 19 . N . 19 . HN parsed_1vrv 1
5 . . . . . . . . . . . . . . . . 8.1000 . . . . . 20 . N . 20 . HN parsed_1vrv 1
6 . . . . . . . . . . . . . . . . 2.6100 . . . . . 21 . N . 21 . HN parsed_1vrv 1
7 . . . . . . . . . . . . . . . . 0.6300 . . . . . 22 . N . 22 . HN parsed_1vrv 1
8 . . . . . . . . . . . . . . . . 8.3100 . . . . . 23 . N . 23 . HN parsed_1vrv 1
9 . . . . . . . . . . . . . . . . 0.7600 . . . . . 24 . N . 24 . HN parsed_1vrv 1
10 . . . . . . . . . . . . . . . . 3.3200 . . . . . 25 . N . 25 . HN parsed_1vrv 1
11 . . . . . . . . . . . . . . . . -9.7100 . . . . . 26 . N . 26 . HN parsed_1vrv 1
12 . . . . . . . . . . . . . . . . -6.8800 . . . . . 27 . N . 27 . HN parsed_1vrv 1
13 . . . . . . . . . . . . . . . . -9.6700 . . . . . 28 . N . 28 . HN parsed_1vrv 1
14 . . . . . . . . . . . . . . . . -7.9700 . . . . . 29 . N . 29 . HN parsed_1vrv 1
15 . . . . . . . . . . . . . . . . -7.8200 . . . . . 30 . N . 30 . HN parsed_1vrv 1
16 . . . . . . . . . . . . . . . . -10.6300 . . . . . 32 . N . 32 . HN parsed_1vrv 1
17 . . . . . . . . . . . . . . . . -9.3100 . . . . . 34 . N . 34 . HN parsed_1vrv 1
18 . . . . . . . . . . . . . . . . -8.5400 . . . . . 35 . N . 35 . HN parsed_1vrv 1
19 . . . . . . . . . . . . . . . . -9.3400 . . . . . 36 . N . 36 . HN parsed_1vrv 1
20 . . . . . . . . . . . . . . . . -7.9800 . . . . . 37 . N . 37 . HN parsed_1vrv 1
21 . . . . . . . . . . . . . . . . -8.8600 . . . . . 39 . N . 39 . HN parsed_1vrv 1
22 . . . . . . . . . . . . . . . . -1.9600 . . . . . 42 . N . 42 . HN parsed_1vrv 1
23 . . . . . . . . . . . . . . . . -4.6800 . . . . . 43 . N . 43 . HN parsed_1vrv 1
24 . . . . . . . . . . . . . . . . -8.0300 . . . . . 44 . N . 44 . HN parsed_1vrv 1
25 . . . . . . . . . . . . . . . . 7.2700 . . . . . 49 . N . 49 . HN parsed_1vrv 1
26 . . . . . . . . . . . . . . . . 10.1500 . . . . . 50 . N . 50 . HN parsed_1vrv 1
27 . . . . . . . . . . . . . . . . 9.6900 . . . . . 51 . N . 51 . HN parsed_1vrv 1
28 . . . . . . . . . . . . . . . . -3.2800 . . . . . 53 . N . 53 . HN parsed_1vrv 1
29 . . . . . . . . . . . . . . . . -5.0700 . . . . . 54 . N . 54 . HN parsed_1vrv 1
30 . . . . . . . . . . . . . . . . -2.4000 . . . . . 56 . N . 56 . HN parsed_1vrv 1
31 . . . . . . . . . . . . . . . . 7.0000 . . . . . 59 . N . 59 . HN parsed_1vrv 1
32 . . . . . . . . . . . . . . . . -7.0600 . . . . . 60 . N . 60 . HN parsed_1vrv 1
33 . . . . . . . . . . . . . . . . 11.0100 . . . . . 64 . N . 64 . HN parsed_1vrv 1
34 . . . . . . . . . . . . . . . . 7.5800 . . . . . 65 . N . 65 . HN parsed_1vrv 1
35 . . . . . . . . . . . . . . . . 4.5000 . . . . . 66 . N . 66 . HN parsed_1vrv 1
36 . . . . . . . . . . . . . . . . 1.2600 . . . . . 68 . N . 68 . HN parsed_1vrv 1
37 . . . . . . . . . . . . . . . . -4.2300 . . . . . 69 . N . 69 . HN parsed_1vrv 1
38 . . . . . . . . . . . . . . . . -1.4500 . . . . . 71 . N . 71 . HN parsed_1vrv 1
39 . . . . . . . . . . . . . . . . -0.1100 . . . . . 74 . N . 74 . HN parsed_1vrv 1
40 . . . . . . . . . . . . . . . . 0.0300 . . . . . 76 . N . 76 . HN parsed_1vrv 1
41 . . . . . . . . . . . . . . . . 1.2500 . . . . . 77 . N . 77 . HN parsed_1vrv 1
42 . . . . . . . . . . . . . . . . 6.5500 . . . . . 79 . N . 79 . HN parsed_1vrv 1
43 . . . . . . . . . . . . . . . . -8.4200 . . . . . 80 . N . 80 . HN parsed_1vrv 1
44 . . . . . . . . . . . . . . . . 5.1900 . . . . . 81 . N . 81 . HN parsed_1vrv 1
45 . . . . . . . . . . . . . . . . 7.6700 . . . . . 82 . N . 82 . HN parsed_1vrv 1
46 . . . . . . . . . . . . . . . . 9.3200 . . . . . 83 . N . 83 . HN parsed_1vrv 1
47 . . . . . . . . . . . . . . . . 1.5500 . . . . . 85 . N . 85 . HN parsed_1vrv 1
48 . . . . . . . . . . . . . . . . -2.8100 . . . . . 89 . N . 89 . HN parsed_1vrv 1
49 . . . . . . . . . . . . . . . . -7.5600 . . . . . 93 . N . 93 . HN parsed_1vrv 1
50 . . . . . . . . . . . . . . . . -5.6700 . . . . . 94 . N . 94 . HN parsed_1vrv 1
51 . . . . . . . . . . . . . . . . -4.5000 . . . . . 95 . N . 95 . HN parsed_1vrv 1
52 . . . . . . . . . . . . . . . . -7.8100 . . . . . 96 . N . 96 . HN parsed_1vrv 1
53 . . . . . . . . . . . . . . . . -4.3900 . . . . . 98 . N . 98 . HN parsed_1vrv 1
54 . . . . . . . . . . . . . . . . -8.0500 . . . . . 100 . N . 100 . HN parsed_1vrv 1
55 . . . . . . . . . . . . . . . . -4.8700 . . . . . 102 . N . 102 . HN parsed_1vrv 1
56 . . . . . . . . . . . . . . . . -7.0100 . . . . . 103 . N . 103 . HN parsed_1vrv 1
57 . . . . . . . . . . . . . . . . -3.0800 . . . . . 105 . N . 105 . HN parsed_1vrv 1
58 . . . . . . . . . . . . . . . . -1.5400 . . . . . 106 . N . 106 . HN parsed_1vrv 1
59 . . . . . . . . . . . . . . . . -1.7427 . . . . . 15 . C . 16 . N parsed_1vrv 1
60 . . . . . . . . . . . . . . . . 0.0830 . . . . . 17 . C . 18 . N parsed_1vrv 1
61 . . . . . . . . . . . . . . . . 1.6598 . . . . . 22 . C . 23 . N parsed_1vrv 1
62 . . . . . . . . . . . . . . . . -3.6515 . . . . . 23 . C . 24 . N parsed_1vrv 1
63 . . . . . . . . . . . . . . . . 10.3734 . . . . . 24 . C . 25 . N parsed_1vrv 1
64 . . . . . . . . . . . . . . . . -2.5726 . . . . . 26 . C . 27 . N parsed_1vrv 1
65 . . . . . . . . . . . . . . . . 1.2448 . . . . . 27 . C . 28 . N parsed_1vrv 1
66 . . . . . . . . . . . . . . . . 0.4149 . . . . . 28 . C . 29 . N parsed_1vrv 1
67 . . . . . . . . . . . . . . . . 6.3071 . . . . . 29 . C . 30 . N parsed_1vrv 1
68 . . . . . . . . . . . . . . . . 2.4896 . . . . . 31 . C . 32 . N parsed_1vrv 1
69 . . . . . . . . . . . . . . . . 3.7344 . . . . . 33 . C . 34 . N parsed_1vrv 1
70 . . . . . . . . . . . . . . . . 8.6307 . . . . . 34 . C . 35 . N parsed_1vrv 1
71 . . . . . . . . . . . . . . . . -1.9917 . . . . . 35 . C . 36 . N parsed_1vrv 1
72 . . . . . . . . . . . . . . . . 3.7344 . . . . . 38 . C . 39 . N parsed_1vrv 1
73 . . . . . . . . . . . . . . . . 9.5436 . . . . . 41 . C . 42 . N parsed_1vrv 1
74 . . . . . . . . . . . . . . . . -2.3237 . . . . . 49 . C . 50 . N parsed_1vrv 1
75 . . . . . . . . . . . . . . . . -2.0747 . . . . . 50 . C . 51 . N parsed_1vrv 1
76 . . . . . . . . . . . . . . . . 2.7386 . . . . . 52 . C . 53 . N parsed_1vrv 1
77 . . . . . . . . . . . . . . . . -5.1452 . . . . . 53 . C . 54 . N parsed_1vrv 1
78 . . . . . . . . . . . . . . . . -4.9793 . . . . . 59 . C . 60 . N parsed_1vrv 1
79 . . . . . . . . . . . . . . . . 0.2490 . . . . . 61 . C . 62 . N parsed_1vrv 1
80 . . . . . . . . . . . . . . . . -1.5768 . . . . . 63 . C . 64 . N parsed_1vrv 1
81 . . . . . . . . . . . . . . . . 3.2365 . . . . . 64 . C . 65 . N parsed_1vrv 1
82 . . . . . . . . . . . . . . . . -9.8755 . . . . . 65 . C . 66 . N parsed_1vrv 1
83 . . . . . . . . . . . . . . . . -0.4149 . . . . . 68 . C . 69 . N parsed_1vrv 1
84 . . . . . . . . . . . . . . . . -2.9876 . . . . . 70 . C . 71 . N parsed_1vrv 1
85 . . . . . . . . . . . . . . . . 9.7095 . . . . . 73 . C . 74 . N parsed_1vrv 1
86 . . . . . . . . . . . . . . . . 4.3983 . . . . . 75 . C . 76 . N parsed_1vrv 1
87 . . . . . . . . . . . . . . . . 0.6639 . . . . . 78 . C . 79 . N parsed_1vrv 1
88 . . . . . . . . . . . . . . . . 1.6598 . . . . . 79 . C . 80 . N parsed_1vrv 1
89 . . . . . . . . . . . . . . . . 2.1577 . . . . . 82 . C . 83 . N parsed_1vrv 1
90 . . . . . . . . . . . . . . . . -1.3278 . . . . . 84 . C . 85 . N parsed_1vrv 1
91 . . . . . . . . . . . . . . . . 1.6598 . . . . . 88 . C . 89 . N parsed_1vrv 1
92 . . . . . . . . . . . . . . . . 2.3237 . . . . . 89 . C . 90 . N parsed_1vrv 1
93 . . . . . . . . . . . . . . . . 0.4979 . . . . . 94 . C . 95 . N parsed_1vrv 1
94 . . . . . . . . . . . . . . . . 5.2282 . . . . . 97 . C . 98 . N parsed_1vrv 1
95 . . . . . . . . . . . . . . . . -9.0456 . . . . . 99 . C . 100 . N parsed_1vrv 1
96 . . . . . . . . . . . . . . . . 5.3112 . . . . . 100 . C . 101 . N parsed_1vrv 1
97 . . . . . . . . . . . . . . . . -1.5768 . . . . . 101 . C . 102 . N parsed_1vrv 1
98 . . . . . . . . . . . . . . . . 6.3071 . . . . . 102 . C . 103 . N parsed_1vrv 1
99 . . . . . . . . . . . . . . . . 2.5726 . . . . . 105 . C . 106 . N parsed_1vrv 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
;
Neutral gel
N-H
;
1 1 3 5 parsed_1vrv 1
2 N-C' 411 1 411 6 parsed_1vrv 1
stop_
save_
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