NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
471320 |
2xa6   |
16969 | cing | 2-parsed | STAR | dipolar coupling | 128 |
data_2xa6_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2xa6
_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_2xa6 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2xa6
_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 2xa6 "Master copy" parsed_2xa6
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2xa6
_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 2xa6.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2xa6 1
1 2xa6.mr . . XPLOR/CNS 2 distance NOE simple 1998 parsed_2xa6 1
1 2xa6.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 128 parsed_2xa6 1
1 2xa6.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2xa6 1
1 2xa6.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2xa6 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2xa6
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 3
_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 . . . . . . . . . . . . . . . . -18.039 . . . . " A" 105 . HA " A" 105 . CA parsed_2xa6 1
2 . . . . . . . . . . . . . . . . -18.039 . . . . " B" 105 . HA " B" 105 . CA parsed_2xa6 1
3 . . . . . . . . . . . . . . . . 0.564 . . . . " A" 106 . HA " A" 106 . CA parsed_2xa6 1
4 . . . . . . . . . . . . . . . . 0.564 . . . . " B" 106 . HA " B" 106 . CA parsed_2xa6 1
5 . . . . . . . . . . . . . . . . 8.455 . . . . " A" 107 . HA " A" 107 . CA parsed_2xa6 1
6 . . . . . . . . . . . . . . . . 8.455 . . . . " B" 107 . HA " B" 107 . CA parsed_2xa6 1
7 . . . . . . . . . . . . . . . . -7.704 . . . . " A" 108 . HA " A" 108 . CA parsed_2xa6 1
8 . . . . . . . . . . . . . . . . -7.704 . . . . " B" 108 . HA " B" 108 . CA parsed_2xa6 1
9 . . . . . . . . . . . . . . . . -5.074 . . . . " A" 109 . HA " A" 109 . CA parsed_2xa6 1
10 . . . . . . . . . . . . . . . . -5.074 . . . . " B" 109 . HA " B" 109 . CA parsed_2xa6 1
11 . . . . . . . . . . . . . . . . 3.382 . . . . " A" 116 . HA " A" 116 . CA parsed_2xa6 1
12 . . . . . . . . . . . . . . . . 3.382 . . . . " B" 116 . HA " B" 116 . CA parsed_2xa6 1
13 . . . . . . . . . . . . . . . . 16.723 . . . . " A" 118 . HA " A" 118 . CA parsed_2xa6 1
14 . . . . . . . . . . . . . . . . 16.723 . . . . " B" 118 . HA " B" 118 . CA parsed_2xa6 1
15 . . . . . . . . . . . . . . . . -6.388 . . . . " A" 121 . HA " A" 121 . CA parsed_2xa6 1
16 . . . . . . . . . . . . . . . . -6.388 . . . . " B" 121 . HA " B" 121 . CA parsed_2xa6 1
17 . . . . . . . . . . . . . . . . 3.006 . . . . " A" 123 . HA " A" 123 . CA parsed_2xa6 1
18 . . . . . . . . . . . . . . . . 3.006 . . . . " B" 123 . HA " B" 123 . CA parsed_2xa6 1
19 . . . . . . . . . . . . . . . . -4.133 . . . . " A" 124 . HA " A" 124 . CA parsed_2xa6 1
20 . . . . . . . . . . . . . . . . -4.133 . . . . " B" 124 . HA " B" 124 . CA parsed_2xa6 1
21 . . . . . . . . . . . . . . . . -10.146 . . . . " A" 125 . HA " A" 125 . CA parsed_2xa6 1
22 . . . . . . . . . . . . . . . . -10.146 . . . . " B" 125 . HA " B" 125 . CA parsed_2xa6 1
23 . . . . . . . . . . . . . . . . 7.328 . . . . " A" 126 . HA " A" 126 . CA parsed_2xa6 1
24 . . . . . . . . . . . . . . . . 7.328 . . . . " B" 126 . HA " B" 126 . CA parsed_2xa6 1
25 . . . . . . . . . . . . . . . . -11.274 . . . . " A" 127 . HA " A" 127 . CA parsed_2xa6 1
26 . . . . . . . . . . . . . . . . -11.274 . . . . " B" 127 . HA " B" 127 . CA parsed_2xa6 1
27 . . . . . . . . . . . . . . . . 6.201 . . . . " A" 128 . HA " A" 128 . CA parsed_2xa6 1
28 . . . . . . . . . . . . . . . . 6.201 . . . . " B" 128 . HA " B" 128 . CA parsed_2xa6 1
29 . . . . . . . . . . . . . . . . 3.946 . . . . " A" 130 . HA " A" 130 . CA parsed_2xa6 1
30 . . . . . . . . . . . . . . . . 3.946 . . . . " B" 130 . HA " B" 130 . CA parsed_2xa6 1
31 . . . . . . . . . . . . . . . . -3.649 . . . . " A" 101 . HN " A" 101 . N parsed_2xa6 1
32 . . . . . . . . . . . . . . . . -3.649 . . . . " B" 101 . HN " B" 101 . N parsed_2xa6 1
33 . . . . . . . . . . . . . . . . -6.462 . . . . " A" 102 . HN " A" 102 . N parsed_2xa6 1
34 . . . . . . . . . . . . . . . . -6.462 . . . . " B" 102 . HN " B" 102 . N parsed_2xa6 1
35 . . . . . . . . . . . . . . . . 1.672 . . . . " A" 103 . HN " A" 103 . N parsed_2xa6 1
36 . . . . . . . . . . . . . . . . 1.672 . . . . " B" 103 . HN " B" 103 . N parsed_2xa6 1
37 . . . . . . . . . . . . . . . . 5.549 . . . . " A" 104 . HN " A" 104 . N parsed_2xa6 1
38 . . . . . . . . . . . . . . . . 5.549 . . . . " B" 104 . HN " B" 104 . N parsed_2xa6 1
39 . . . . . . . . . . . . . . . . -0.608 . . . . " A" 106 . HN " A" 106 . N parsed_2xa6 1
40 . . . . . . . . . . . . . . . . -0.608 . . . . " B" 106 . HN " B" 106 . N parsed_2xa6 1
41 . . . . . . . . . . . . . . . . 6.766 . . . . " A" 107 . HN " A" 107 . N parsed_2xa6 1
42 . . . . . . . . . . . . . . . . 6.766 . . . . " B" 107 . HN " B" 107 . N parsed_2xa6 1
43 . . . . . . . . . . . . . . . . 3.269 . . . . " A" 108 . HN " A" 108 . N parsed_2xa6 1
44 . . . . . . . . . . . . . . . . 3.269 . . . . " B" 108 . HN " B" 108 . N parsed_2xa6 1
45 . . . . . . . . . . . . . . . . -4.713 . . . . " A" 109 . HN " A" 109 . N parsed_2xa6 1
46 . . . . . . . . . . . . . . . . -4.713 . . . . " B" 109 . HN " B" 109 . N parsed_2xa6 1
47 . . . . . . . . . . . . . . . . 1.976 . . . . " A" 110 . HN " A" 110 . N parsed_2xa6 1
48 . . . . . . . . . . . . . . . . 1.976 . . . . " B" 110 . HN " B" 110 . N parsed_2xa6 1
49 . . . . . . . . . . . . . . . . 4.029 . . . . " A" 111 . HN " A" 111 . N parsed_2xa6 1
50 . . . . . . . . . . . . . . . . 4.029 . . . . " B" 111 . HN " B" 111 . N parsed_2xa6 1
51 . . . . . . . . . . . . . . . . -1.292 . . . . " A" 112 . HN " A" 112 . N parsed_2xa6 1
52 . . . . . . . . . . . . . . . . -1.292 . . . . " B" 112 . HN " B" 112 . N parsed_2xa6 1
53 . . . . . . . . . . . . . . . . 2.585 . . . . " A" 117 . HN " A" 117 . N parsed_2xa6 1
54 . . . . . . . . . . . . . . . . 2.585 . . . . " B" 117 . HN " B" 117 . N parsed_2xa6 1
55 . . . . . . . . . . . . . . . . 12.391 . . . . " A" 118 . HN " A" 118 . N parsed_2xa6 1
56 . . . . . . . . . . . . . . . . 12.391 . . . . " B" 118 . HN " B" 118 . N parsed_2xa6 1
57 . . . . . . . . . . . . . . . . 10.491 . . . . " A" 119 . HN " A" 119 . N parsed_2xa6 1
58 . . . . . . . . . . . . . . . . 10.491 . . . . " B" 119 . HN " B" 119 . N parsed_2xa6 1
59 . . . . . . . . . . . . . . . . 7.830 . . . . " A" 121 . HN " A" 121 . N parsed_2xa6 1
60 . . . . . . . . . . . . . . . . 7.830 . . . . " B" 121 . HN " B" 121 . N parsed_2xa6 1
61 . . . . . . . . . . . . . . . . 7.678 . . . . " A" 122 . HN " A" 122 . N parsed_2xa6 1
62 . . . . . . . . . . . . . . . . 7.678 . . . . " B" 122 . HN " B" 122 . N parsed_2xa6 1
63 . . . . . . . . . . . . . . . . 13.075 . . . . " A" 123 . HN " A" 123 . N parsed_2xa6 1
64 . . . . . . . . . . . . . . . . 13.075 . . . . " B" 123 . HN " B" 123 . N parsed_2xa6 1
65 . . . . . . . . . . . . . . . . 9.350 . . . . " A" 124 . HN " A" 124 . N parsed_2xa6 1
66 . . . . . . . . . . . . . . . . 9.350 . . . . " B" 124 . HN " B" 124 . N parsed_2xa6 1
67 . . . . . . . . . . . . . . . . 2.433 . . . . " A" 125 . HN " A" 125 . N parsed_2xa6 1
68 . . . . . . . . . . . . . . . . 2.433 . . . . " B" 125 . HN " B" 125 . N parsed_2xa6 1
69 . . . . . . . . . . . . . . . . 10.947 . . . . " A" 126 . HN " A" 126 . N parsed_2xa6 1
70 . . . . . . . . . . . . . . . . 10.947 . . . . " B" 126 . HN " B" 126 . N parsed_2xa6 1
71 . . . . . . . . . . . . . . . . 11.631 . . . . " A" 127 . HN " A" 127 . N parsed_2xa6 1
72 . . . . . . . . . . . . . . . . 11.631 . . . . " B" 127 . HN " B" 127 . N parsed_2xa6 1
73 . . . . . . . . . . . . . . . . 8.970 . . . . " A" 128 . HN " A" 128 . N parsed_2xa6 1
74 . . . . . . . . . . . . . . . . 8.970 . . . . " B" 128 . HN " B" 128 . N parsed_2xa6 1
75 . . . . . . . . . . . . . . . . 7.374 . . . . " A" 129 . HN " A" 129 . N parsed_2xa6 1
76 . . . . . . . . . . . . . . . . 7.374 . . . . " B" 129 . HN " B" 129 . N parsed_2xa6 1
77 . . . . . . . . . . . . . . . . 11.555 . . . . " A" 130 . HN " A" 130 . N parsed_2xa6 1
78 . . . . . . . . . . . . . . . . 11.555 . . . . " B" 130 . HN " B" 130 . N parsed_2xa6 1
79 . . . . . . . . . . . . . . . . 5.444 . . . . " A" 101 . N " A" 100 . C parsed_2xa6 1
80 . . . . . . . . . . . . . . . . 5.444 . . . . " B" 101 . N " B" 100 . C parsed_2xa6 1
81 . . . . . . . . . . . . . . . . -5.234 . . . . " A" 102 . N " A" 101 . C parsed_2xa6 1
82 . . . . . . . . . . . . . . . . -5.234 . . . . " B" 102 . N " B" 101 . C parsed_2xa6 1
83 . . . . . . . . . . . . . . . . 11.519 . . . . " A" 103 . N " A" 102 . C parsed_2xa6 1
84 . . . . . . . . . . . . . . . . 11.519 . . . . " B" 103 . N " B" 102 . C parsed_2xa6 1
85 . . . . . . . . . . . . . . . . 0.837 . . . . " A" 104 . N " A" 103 . C parsed_2xa6 1
86 . . . . . . . . . . . . . . . . 0.837 . . . . " B" 104 . N " B" 103 . C parsed_2xa6 1
87 . . . . . . . . . . . . . . . . -7.540 . . . . " A" 106 . N " A" 105 . C parsed_2xa6 1
88 . . . . . . . . . . . . . . . . -7.540 . . . . " B" 106 . N " B" 105 . C parsed_2xa6 1
89 . . . . . . . . . . . . . . . . 0.837 . . . . " A" 107 . N " A" 106 . C parsed_2xa6 1
90 . . . . . . . . . . . . . . . . 0.837 . . . . " B" 107 . N " B" 106 . C parsed_2xa6 1
91 . . . . . . . . . . . . . . . . 11.100 . . . . " A" 108 . N " A" 107 . C parsed_2xa6 1
92 . . . . . . . . . . . . . . . . 11.100 . . . . " B" 108 . N " B" 107 . C parsed_2xa6 1
93 . . . . . . . . . . . . . . . . -13.822 . . . . " A" 109 . N " A" 108 . C parsed_2xa6 1
94 . . . . . . . . . . . . . . . . -13.822 . . . . " B" 109 . N " B" 108 . C parsed_2xa6 1
95 . . . . . . . . . . . . . . . . 1.256 . . . . " A" 110 . N " A" 109 . C parsed_2xa6 1
96 . . . . . . . . . . . . . . . . 1.256 . . . . " B" 110 . N " B" 109 . C parsed_2xa6 1
97 . . . . . . . . . . . . . . . . 5.444 . . . . " A" 111 . N " A" 110 . C parsed_2xa6 1
98 . . . . . . . . . . . . . . . . 5.444 . . . . " B" 111 . N " B" 110 . C parsed_2xa6 1
99 . . . . . . . . . . . . . . . . 12.147 . . . . " A" 112 . N " A" 111 . C parsed_2xa6 1
100 . . . . . . . . . . . . . . . . 12.147 . . . . " B" 112 . N " B" 111 . C parsed_2xa6 1
101 . . . . . . . . . . . . . . . . 2.513 . . . . " A" 117 . N " A" 116 . C parsed_2xa6 1
102 . . . . . . . . . . . . . . . . 2.513 . . . . " B" 117 . N " B" 116 . C parsed_2xa6 1
103 . . . . . . . . . . . . . . . . -1.884 . . . . " A" 118 . N " A" 117 . C parsed_2xa6 1
104 . . . . . . . . . . . . . . . . -1.884 . . . . " B" 118 . N " B" 117 . C parsed_2xa6 1
105 . . . . . . . . . . . . . . . . -3.978 . . . . " A" 119 . N " A" 118 . C parsed_2xa6 1
106 . . . . . . . . . . . . . . . . -3.978 . . . . " B" 119 . N " B" 118 . C parsed_2xa6 1
107 . . . . . . . . . . . . . . . . -13.403 . . . . " A" 122 . N " A" 121 . C parsed_2xa6 1
108 . . . . . . . . . . . . . . . . -13.403 . . . . " B" 122 . N " B" 121 . C parsed_2xa6 1
109 . . . . . . . . . . . . . . . . 9.215 . . . . " A" 123 . N " A" 122 . C parsed_2xa6 1
110 . . . . . . . . . . . . . . . . 9.215 . . . . " B" 123 . N " B" 122 . C parsed_2xa6 1
111 . . . . . . . . . . . . . . . . -10.262 . . . . " A" 124 . N " A" 123 . C parsed_2xa6 1
112 . . . . . . . . . . . . . . . . -10.262 . . . . " B" 124 . N " B" 123 . C parsed_2xa6 1
113 . . . . . . . . . . . . . . . . 2.722 . . . . " A" 125 . N " A" 124 . C parsed_2xa6 1
114 . . . . . . . . . . . . . . . . 2.722 . . . . " B" 125 . N " B" 124 . C parsed_2xa6 1
115 . . . . . . . . . . . . . . . . -11.519 . . . . " A" 126 . N " A" 125 . C parsed_2xa6 1
116 . . . . . . . . . . . . . . . . -11.519 . . . . " B" 126 . N " B" 125 . C parsed_2xa6 1
117 . . . . . . . . . . . . . . . . 10.053 . . . . " A" 127 . N " A" 126 . C parsed_2xa6 1
118 . . . . . . . . . . . . . . . . 10.053 . . . . " B" 127 . N " B" 126 . C parsed_2xa6 1
119 . . . . . . . . . . . . . . . . -11.728 . . . . " A" 128 . N " A" 127 . C parsed_2xa6 1
120 . . . . . . . . . . . . . . . . -11.728 . . . . " B" 128 . N " B" 127 . C parsed_2xa6 1
121 . . . . . . . . . . . . . . . . -2.722 . . . . " A" 129 . N " A" 128 . C parsed_2xa6 1
122 . . . . . . . . . . . . . . . . -2.722 . . . . " B" 129 . N " B" 128 . C parsed_2xa6 1
123 . . . . . . . . . . . . . . . . -3.559 . . . . " A" 130 . N " A" 129 . C parsed_2xa6 1
124 . . . . . . . . . . . . . . . . -3.559 . . . . " B" 130 . N " B" 129 . C parsed_2xa6 1
125 . . . . . . . . . . . . . . . . -5.025 . . . . " A" 131 . N " A" 130 . C parsed_2xa6 1
126 . . . . . . . . . . . . . . . . -5.025 . . . . " B" 131 . N " B" 130 . C parsed_2xa6 1
127 . . . . . . . . . . . . . . . . 1.047 . . . . " A" 132 . N " A" 131 . C parsed_2xa6 1
128 . . . . . . . . . . . . . . . . 1.047 . . . . " B" 132 . N " B" 131 . C parsed_2xa6 1
stop_
save_
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