NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
639810 |
6i9f   |
18632 | cing | 2-parsed | STAR | dipolar coupling | 113 |
data_6i9f_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6i9f
_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_6i9f 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6i9f
_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 6i9f "Master copy" parsed_6i9f
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6i9f
_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 6i9f.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6i9f 1
1 6i9f.mr . . XPLOR/CNS 2 distance NOE ambi 4529 parsed_6i9f 1
1 6i9f.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 108 parsed_6i9f 1
1 6i9f.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 113 parsed_6i9f 1
1 6i9f.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6i9f 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_6i9f
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . 0.7080 . . . . " A" 1 . HN " A" 1 . N parsed_6i9f 1
2 . . . . . . . . . . . . . . . . -5.7680 . . . . " A" 2 . HN " A" 2 . N parsed_6i9f 1
3 . . . . . . . . . . . . . . . . -2.0300 . . . . " A" 3 . HN " A" 3 . N parsed_6i9f 1
4 . . . . . . . . . . . . . . . . -2.5490 . . . . " A" 5 . HN " A" 5 . N parsed_6i9f 1
5 . . . . . . . . . . . . . . . . -3.8690 . . . . " A" 6 . HN " A" 6 . N parsed_6i9f 1
6 . . . . . . . . . . . . . . . . 3.4460 . . . . " A" 7 . HN " A" 7 . N parsed_6i9f 1
7 . . . . . . . . . . . . . . . . -1.7860 . . . . " A" 8 . HN " A" 8 . N parsed_6i9f 1
8 . . . . . . . . . . . . . . . . 6.2580 . . . . " A" 9 . HN " A" 9 . N parsed_6i9f 1
9 . . . . . . . . . . . . . . . . 6.8270 . . . . " A" 11 . HN " A" 11 . N parsed_6i9f 1
10 . . . . . . . . . . . . . . . . 3.9610 . . . . " A" 12 . HN " A" 12 . N parsed_6i9f 1
11 . . . . . . . . . . . . . . . . -0.1140 . . . . " A" 13 . HN " A" 13 . N parsed_6i9f 1
12 . . . . . . . . . . . . . . . . -2.3010 . . . . " A" 14 . HN " A" 14 . N parsed_6i9f 1
13 . . . . . . . . . . . . . . . . 1.6740 . . . . " A" 15 . HN " A" 15 . N parsed_6i9f 1
14 . . . . . . . . . . . . . . . . 4.1910 . . . . " A" 16 . HN " A" 16 . N parsed_6i9f 1
15 . . . . . . . . . . . . . . . . 5.8000 . . . . " A" 17 . HN " A" 17 . N parsed_6i9f 1
16 . . . . . . . . . . . . . . . . 10.0830 . . . . " A" 19 . HN " A" 19 . N parsed_6i9f 1
17 . . . . . . . . . . . . . . . . 8.5120 . . . . " A" 20 . HN " A" 20 . N parsed_6i9f 1
18 . . . . . . . . . . . . . . . . 5.7860 . . . . " A" 21 . HN " A" 21 . N parsed_6i9f 1
19 . . . . . . . . . . . . . . . . 4.7670 . . . . " A" 24 . HN " A" 24 . N parsed_6i9f 1
20 . . . . . . . . . . . . . . . . 7.0340 . . . . " A" 25 . HN " A" 25 . N parsed_6i9f 1
21 . . . . . . . . . . . . . . . . 9.2970 . . . . " A" 26 . HN " A" 26 . N parsed_6i9f 1
22 . . . . . . . . . . . . . . . . 3.6120 . . . . " A" 27 . HN " A" 27 . N parsed_6i9f 1
23 . . . . . . . . . . . . . . . . -2.9610 . . . . " A" 28 . HN " A" 28 . N parsed_6i9f 1
24 . . . . . . . . . . . . . . . . 0.8420 . . . . " A" 29 . HN " A" 29 . N parsed_6i9f 1
25 . . . . . . . . . . . . . . . . 2.7710 . . . . " A" 34 . HN " A" 34 . N parsed_6i9f 1
26 . . . . . . . . . . . . . . . . 6.1560 . . . . " A" 35 . HN " A" 35 . N parsed_6i9f 1
27 . . . . . . . . . . . . . . . . 4.7790 . . . . " A" 36 . HN " A" 36 . N parsed_6i9f 1
28 . . . . . . . . . . . . . . . . 4.1680 . . . . " A" 38 . HN " A" 38 . N parsed_6i9f 1
29 . . . . . . . . . . . . . . . . -6.0580 . . . . " A" 40 . HN " A" 40 . N parsed_6i9f 1
30 . . . . . . . . . . . . . . . . 2.8340 . . . . " A" 41 . HN " A" 41 . N parsed_6i9f 1
31 . . . . . . . . . . . . . . . . 0.1420 . . . . " A" 42 . HN " A" 42 . N parsed_6i9f 1
32 . . . . . . . . . . . . . . . . 4.4180 . . . . " A" 43 . HN " A" 43 . N parsed_6i9f 1
33 . . . . . . . . . . . . . . . . 5.5090 . . . . " A" 44 . HN " A" 44 . N parsed_6i9f 1
34 . . . . . . . . . . . . . . . . 8.2900 . . . . " A" 45 . HN " A" 45 . N parsed_6i9f 1
35 . . . . . . . . . . . . . . . . 8.8260 . . . . " A" 47 . HN " A" 47 . N parsed_6i9f 1
36 . . . . . . . . . . . . . . . . -0.9920 . . . . " A" 48 . HN " A" 48 . N parsed_6i9f 1
37 . . . . . . . . . . . . . . . . 0.6670 . . . . " A" 49 . HN " A" 49 . N parsed_6i9f 1
38 . . . . . . . . . . . . . . . . 3.1050 . . . . " A" 50 . HN " A" 50 . N parsed_6i9f 1
39 . . . . . . . . . . . . . . . . 2.9600 . . . . " A" 51 . HN " A" 51 . N parsed_6i9f 1
40 . . . . . . . . . . . . . . . . -1.5220 . . . . " A" 52 . HN " A" 52 . N parsed_6i9f 1
41 . . . . . . . . . . . . . . . . 8.5040 . . . . " A" 54 . HN " A" 54 . N parsed_6i9f 1
42 . . . . . . . . . . . . . . . . 4.3800 . . . . " A" 55 . HN " A" 55 . N parsed_6i9f 1
43 . . . . . . . . . . . . . . . . 1.3810 . . . . " A" 56 . HN " A" 56 . N parsed_6i9f 1
44 . . . . . . . . . . . . . . . . 3.4670 . . . . " A" 58 . HN " A" 58 . N parsed_6i9f 1
45 . . . . . . . . . . . . . . . . 2.4690 . . . . " A" 59 . HN " A" 59 . N parsed_6i9f 1
46 . . . . . . . . . . . . . . . . 2.3900 . . . . " A" 60 . HN " A" 60 . N parsed_6i9f 1
47 . . . . . . . . . . . . . . . . -0.5710 . . . . " A" 61 . HN " A" 61 . N parsed_6i9f 1
48 . . . . . . . . . . . . . . . . -3.5860 . . . . " A" 63 . HN " A" 63 . N parsed_6i9f 1
49 . . . . . . . . . . . . . . . . -8.7560 . . . . " A" 64 . HN " A" 64 . N parsed_6i9f 1
50 . . . . . . . . . . . . . . . . -2.6180 . . . . " A" 66 . HN " A" 66 . N parsed_6i9f 1
51 . . . . . . . . . . . . . . . . 4.2000 . . . . " A" 67 . HN " A" 67 . N parsed_6i9f 1
52 . . . . . . . . . . . . . . . . 6.6090 . . . . " A" 68 . HN " A" 68 . N parsed_6i9f 1
53 . . . . . . . . . . . . . . . . 10.3390 . . . . " A" 71 . HN " A" 71 . N parsed_6i9f 1
54 . . . . . . . . . . . . . . . . 8.5620 . . . . " A" 72 . HN " A" 72 . N parsed_6i9f 1
55 . . . . . . . . . . . . . . . . 5.7550 . . . . " A" 73 . HN " A" 73 . N parsed_6i9f 1
56 . . . . . . . . . . . . . . . . 3.1790 . . . . " A" 74 . HN " A" 74 . N parsed_6i9f 1
57 . . . . . . . . . . . . . . . . 3.9970 . . . . " A" 75 . HN " A" 75 . N parsed_6i9f 1
58 . . . . . . . . . . . . . . . . 7.7640 . . . . " A" 76 . HN " A" 76 . N parsed_6i9f 1
59 . . . . . . . . . . . . . . . . 3.2530 . . . . " A" 77 . HN " A" 77 . N parsed_6i9f 1
60 . . . . . . . . . . . . . . . . 4.7340 . . . . " A" 78 . HN " A" 78 . N parsed_6i9f 1
61 . . . . . . . . . . . . . . . . 1.6280 . . . . " A" 79 . HN " A" 79 . N parsed_6i9f 1
62 . . . . . . . . . . . . . . . . 1.1740 . . . . " A" 80 . HN " A" 80 . N parsed_6i9f 1
63 . . . . . . . . . . . . . . . . 1.8200 . . . . " A" 81 . HN " A" 81 . N parsed_6i9f 1
64 . . . . . . . . . . . . . . . . 6.8620 . . . . " A" 82 . HN " A" 82 . N parsed_6i9f 1
65 . . . . . . . . . . . . . . . . -4.8710 . . . . " A" 83 . HN " A" 83 . N parsed_6i9f 1
66 . . . . . . . . . . . . . . . . -2.9430 . . . . " A" 84 . HN " A" 84 . N parsed_6i9f 1
67 . . . . . . . . . . . . . . . . 0.5440 . . . . " A" 85 . HN " A" 85 . N parsed_6i9f 1
68 . . . . . . . . . . . . . . . . 3.5350 . . . . " A" 87 . HN " A" 87 . N parsed_6i9f 1
69 . . . . . . . . . . . . . . . . 4.2340 . . . . " A" 88 . HN " A" 88 . N parsed_6i9f 1
70 . . . . . . . . . . . . . . . . 1.3950 . . . . " A" 89 . HN " A" 89 . N parsed_6i9f 1
71 . . . . . . . . . . . . . . . . 1.6850 . . . . " A" 90 . HN " A" 90 . N parsed_6i9f 1
72 . . . . . . . . . . . . . . . . 4.4350 . . . . " A" 92 . HN " A" 92 . N parsed_6i9f 1
73 . . . . . . . . . . . . . . . . 5.1740 . . . . " A" 93 . HN " A" 93 . N parsed_6i9f 1
74 . . . . . . . . . . . . . . . . 4.1770 . . . . " A" 94 . HN " A" 94 . N parsed_6i9f 1
75 . . . . . . . . . . . . . . . . 3.5800 . . . . " A" 95 . HN " A" 95 . N parsed_6i9f 1
76 . . . . . . . . . . . . . . . . -3.3070 . . . . " A" 96 . HN " A" 96 . N parsed_6i9f 1
77 . . . . . . . . . . . . . . . . 2.2230 . . . . " A" 98 . HN " A" 98 . N parsed_6i9f 1
78 . . . . . . . . . . . . . . . . 5.9050 . . . . " A" 100 . HN " A" 100 . N parsed_6i9f 1
79 . . . . . . . . . . . . . . . . 4.3940 . . . . " A" 101 . HN " A" 101 . N parsed_6i9f 1
80 . . . . . . . . . . . . . . . . 3.7130 . . . . " A" 102 . HN " A" 102 . N parsed_6i9f 1
81 . . . . . . . . . . . . . . . . 1.8130 . . . . " A" 103 . HN " A" 103 . N parsed_6i9f 1
82 . . . . . . . . . . . . . . . . 2.1550 . . . . " A" 104 . HN " A" 104 . N parsed_6i9f 1
83 . . . . . . . . . . . . . . . . 0.7560 . . . . " A" 106 . HN " A" 106 . N parsed_6i9f 1
84 . . . . . . . . . . . . . . . . 3.5330 . . . . " A" 107 . HN " A" 107 . N parsed_6i9f 1
85 . . . . . . . . . . . . . . . . 7.6070 . . . . " A" 108 . HN " A" 108 . N parsed_6i9f 1
86 . . . . . . . . . . . . . . . . 4.3560 . . . . " A" 109 . HN " A" 109 . N parsed_6i9f 1
87 . . . . . . . . . . . . . . . . -3.9740 . . . . " A" 111 . HN " A" 111 . N parsed_6i9f 1
88 . . . . . . . . . . . . . . . . -0.5570 . . . . " A" 112 . HN " A" 112 . N parsed_6i9f 1
89 . . . . . . . . . . . . . . . . 0.0200 . . . . " A" 113 . HN " A" 113 . N parsed_6i9f 1
90 . . . . . . . . . . . . . . . . -0.0630 . . . . " A" 114 . HN " A" 114 . N parsed_6i9f 1
91 . . . . . . . . . . . . . . . . 0.5280 . . . . " A" 115 . HN " A" 115 . N parsed_6i9f 1
92 . . . . . . . . . . . . . . . . 2.8890 . . . . " A" 116 . HN " A" 116 . N parsed_6i9f 1
93 . . . . . . . . . . . . . . . . 11.1080 . . . . " A" 117 . HN " A" 117 . N parsed_6i9f 1
94 . . . . . . . . . . . . . . . . 5.8720 . . . . " A" 118 . HN " A" 118 . N parsed_6i9f 1
95 . . . . . . . . . . . . . . . . -1.5040 . . . . " A" 119 . HN " A" 119 . N parsed_6i9f 1
96 . . . . . . . . . . . . . . . . -2.0770 . . . . " A" 120 . HN " A" 120 . N parsed_6i9f 1
97 . . . . . . . . . . . . . . . . -5.8360 . . . . " A" 121 . HN " A" 121 . N parsed_6i9f 1
98 . . . . . . . . . . . . . . . . -5.6360 . . . . " A" 124 . HN " A" 124 . N parsed_6i9f 1
99 . . . . . . . . . . . . . . . . -5.5440 . . . . " A" 125 . HN " A" 125 . N parsed_6i9f 1
100 . . . . . . . . . . . . . . . . -0.1630 . . . . " A" 126 . HN " A" 126 . N parsed_6i9f 1
101 . . . . . . . . . . . . . . . . 3.1660 . . . . " A" 127 . HN " A" 127 . N parsed_6i9f 1
102 . . . . . . . . . . . . . . . . 4.3610 . . . . " A" 128 . HN " A" 128 . N parsed_6i9f 1
103 . . . . . . . . . . . . . . . . 4.6630 . . . . " A" 130 . HN " A" 130 . N parsed_6i9f 1
104 . . . . . . . . . . . . . . . . 7.2650 . . . . " A" 131 . HN " A" 131 . N parsed_6i9f 1
105 . . . . . . . . . . . . . . . . 6.5160 . . . . " A" 132 . HN " A" 132 . N parsed_6i9f 1
106 . . . . . . . . . . . . . . . . 2.6020 . . . . " A" 133 . HN " A" 133 . N parsed_6i9f 1
107 . . . . . . . . . . . . . . . . 3.3970 . . . . " A" 134 . HN " A" 134 . N parsed_6i9f 1
108 . . . . . . . . . . . . . . . . 5.7740 . . . . " A" 136 . HN " A" 136 . N parsed_6i9f 1
109 . . . . . . . . . . . . . . . . 3.5320 . . . . " A" 137 . HN " A" 137 . N parsed_6i9f 1
110 . . . . . . . . . . . . . . . . -1.8500 . . . . " A" 140 . HN " A" 140 . N parsed_6i9f 1
111 . . . . . . . . . . . . . . . . -5.7380 . . . . " A" 141 . HN " A" 141 . N parsed_6i9f 1
112 . . . . . . . . . . . . . . . . -5.3810 . . . . " A" 142 . HN " A" 142 . N parsed_6i9f 1
113 . . . . . . . . . . . . . . . . 9.4830 . . . . " A" 143 . HN " A" 143 . N parsed_6i9f 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 4: 26_2.tbl" 1 1 1 29 parsed_6i9f 1
stop_
save_
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