NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
565320 |
2m3c   |
18953 | cing | 2-parsed | STAR | dipolar coupling | 131 |
data_2m3c_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2m3c
_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_2m3c 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2m3c
_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 2m3c "Master copy" parsed_2m3c
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2m3c
_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 2m3c.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2m3c 1
1 2m3c.mr . . XPLOR/CNS 2 distance NOE simple 946 parsed_2m3c 1
1 2m3c.mr . . XPLOR/CNS 3 distance NOE ambi 17 parsed_2m3c 1
1 2m3c.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 131 parsed_2m3c 1
1 2m3c.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2m3c 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2m3c
_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 . . . . . . . . . . . . . . . . 12.214 11.788 12.640 . . . 3 . N . 3 . HN parsed_2m3c 1
2 . . . . . . . . . . . . . . . . 19.402 18.586 20.218 . . . 4 . N . 4 . HN parsed_2m3c 1
3 . . . . . . . . . . . . . . . . 13.346 12.643 14.049 . . . 5 . N . 5 . HN parsed_2m3c 1
4 . . . . . . . . . . . . . . . . -5.612 -6.317 -4.907 . . . 7 . N . 7 . HN parsed_2m3c 1
5 . . . . . . . . . . . . . . . . -2.276 -3.049 -1.503 . . . 8 . N . 8 . HN parsed_2m3c 1
6 . . . . . . . . . . . . . . . . -20.508 -21.291 -19.725 . . . 14 . N . 14 . HN parsed_2m3c 1
7 . . . . . . . . . . . . . . . . 6.790 6.040 7.540 . . . 17 . N . 17 . HN parsed_2m3c 1
8 . . . . . . . . . . . . . . . . -3.084 -3.542 -2.626 . . . 18 . N . 18 . HN parsed_2m3c 1
9 . . . . . . . . . . . . . . . . 17.924 17.059 18.789 . . . 19 . N . 19 . HN parsed_2m3c 1
10 . . . . . . . . . . . . . . . . 11.480 10.678 12.282 . . . 20 . N . 20 . HN parsed_2m3c 1
11 . . . . . . . . . . . . . . . . -1.614 -2.036 -1.192 . . . 21 . N . 21 . HN parsed_2m3c 1
12 . . . . . . . . . . . . . . . . 6.392 6.126 6.658 . . . 22 . N . 22 . HN parsed_2m3c 1
13 . . . . . . . . . . . . . . . . 9.690 9.423 9.957 . . . 25 . N . 25 . HN parsed_2m3c 1
14 . . . . . . . . . . . . . . . . -7.292 -8.120 -6.464 . . . 26 . N . 26 . HN parsed_2m3c 1
15 . . . . . . . . . . . . . . . . -25.292 -25.707 -24.877 . . . 28 . N . 28 . HN parsed_2m3c 1
16 . . . . . . . . . . . . . . . . -20.830 -21.332 -20.328 . . . 29 . N . 29 . HN parsed_2m3c 1
17 . . . . . . . . . . . . . . . . -27.382 -27.866 -26.898 . . . 30 . N . 30 . HN parsed_2m3c 1
18 . . . . . . . . . . . . . . . . -28.252 -30.581 -25.923 . . . 31 . N . 31 . HN parsed_2m3c 1
19 . . . . . . . . . . . . . . . . -0.906 -1.337 -0.475 . . . 32 . N . 32 . HN parsed_2m3c 1
20 . . . . . . . . . . . . . . . . 0.232 -0.345 0.809 . . . 33 . N . 33 . HN parsed_2m3c 1
21 . . . . . . . . . . . . . . . . -19.768 -21.341 -18.195 . . . 34 . N . 34 . HN parsed_2m3c 1
22 . . . . . . . . . . . . . . . . 16.218 15.580 16.856 . . . 37 . N . 37 . HN parsed_2m3c 1
23 . . . . . . . . . . . . . . . . 18.872 18.208 19.536 . . . 38 . N . 38 . HN parsed_2m3c 1
24 . . . . . . . . . . . . . . . . 17.238 16.492 17.984 . . . 39 . N . 39 . HN parsed_2m3c 1
25 . . . . . . . . . . . . . . . . 12.056 11.704 12.408 . . . 40 . N . 40 . HN parsed_2m3c 1
26 . . . . . . . . . . . . . . . . 11.552 10.934 12.170 . . . 41 . N . 41 . HN parsed_2m3c 1
27 . . . . . . . . . . . . . . . . 14.856 14.531 15.181 . . . 42 . N . 42 . HN parsed_2m3c 1
28 . . . . . . . . . . . . . . . . 18.194 17.728 18.660 . . . 43 . N . 43 . HN parsed_2m3c 1
29 . . . . . . . . . . . . . . . . 19.678 18.589 20.767 . . . 44 . N . 44 . HN parsed_2m3c 1
30 . . . . . . . . . . . . . . . . 10.262 9.332 11.192 . . . 45 . N . 45 . HN parsed_2m3c 1
31 . . . . . . . . . . . . . . . . -5.490 -6.063 -4.917 . . . 46 . N . 46 . HN parsed_2m3c 1
32 . . . . . . . . . . . . . . . . -23.664 -24.323 -23.005 . . . 47 . N . 47 . HN parsed_2m3c 1
33 . . . . . . . . . . . . . . . . -3.194 -3.574 -2.814 . . . 48 . N . 48 . HN parsed_2m3c 1
34 . . . . . . . . . . . . . . . . 9.934 9.465 10.403 . . . 49 . N . 49 . HN parsed_2m3c 1
35 . . . . . . . . . . . . . . . . -20.048 -21.141 -18.955 . . . 50 . N . 50 . HN parsed_2m3c 1
36 . . . . . . . . . . . . . . . . -33.276 -34.425 -32.127 . . . 51 . N . 51 . HN parsed_2m3c 1
37 . . . . . . . . . . . . . . . . -28.340 -28.758 -27.922 . . . 52 . N . 52 . HN parsed_2m3c 1
38 . . . . . . . . . . . . . . . . -24.288 -24.923 -23.653 . . . 53 . N . 53 . HN parsed_2m3c 1
39 . . . . . . . . . . . . . . . . -19.198 -19.858 -18.538 . . . 55 . N . 55 . HN parsed_2m3c 1
40 . . . . . . . . . . . . . . . . 3.860 3.165 4.555 . . . 56 . N . 56 . HN parsed_2m3c 1
41 . . . . . . . . . . . . . . . . 17.834 17.146 18.522 . . . 58 . N . 58 . HN parsed_2m3c 1
42 . . . . . . . . . . . . . . . . 17.990 17.542 18.438 . . . 59 . N . 59 . HN parsed_2m3c 1
43 . . . . . . . . . . . . . . . . 8.354 7.721 8.987 . . . 61 . N . 61 . HN parsed_2m3c 1
44 . . . . . . . . . . . . . . . . 12.390 12.129 12.651 . . . 62 . N . 62 . HN parsed_2m3c 1
45 . . . . . . . . . . . . . . . . 15.852 15.168 16.536 . . . 63 . N . 63 . HN parsed_2m3c 1
46 . . . . . . . . . . . . . . . . -16.700 -18.221 -15.179 . . . 65 . N . 65 . HN parsed_2m3c 1
47 . . . . . . . . . . . . . . . . -8.616 -14.369 -2.863 . . . 66 . N . 66 . HN parsed_2m3c 1
48 . . . . . . . . . . . . . . . . -14.756 -16.809 -12.703 . . . 68 . N . 68 . HN parsed_2m3c 1
49 . . . . . . . . . . . . . . . . -9.028 -9.423 -8.633 . . . 69 . N . 69 . HN parsed_2m3c 1
50 . . . . . . . . . . . . . . . . -17.846 -18.371 -17.321 . . . 70 . N . 70 . HN parsed_2m3c 1
51 . . . . . . . . . . . . . . . . -25.216 -25.622 -24.810 . . . 71 . N . 71 . HN parsed_2m3c 1
52 . . . . . . . . . . . . . . . . -14.740 -15.071 -14.409 . . . 72 . N . 72 . HN parsed_2m3c 1
53 . . . . . . . . . . . . . . . . 2.874 2.593 3.155 . . . 75 . N . 75 . HN parsed_2m3c 1
54 . . . . . . . . . . . . . . . . -10.710 -11.781 -9.639 . . . 76 . N . 76 . HN parsed_2m3c 1
55 . . . . . . . . . . . . . . . . -26.000 -27.530 -24.470 . . . 77 . N . 77 . HN parsed_2m3c 1
56 . . . . . . . . . . . . . . . . 15.330 14.776 15.884 . . . 78 . N . 78 . HN parsed_2m3c 1
57 . . . . . . . . . . . . . . . . 17.776 17.093 18.459 . . . 79 . N . 79 . HN parsed_2m3c 1
58 . . . . . . . . . . . . . . . . 20.762 19.730 21.794 . . . 80 . N . 80 . HN parsed_2m3c 1
59 . . . . . . . . . . . . . . . . 18.772 17.919 19.625 . . . 81 . N . 81 . HN parsed_2m3c 1
60 . . . . . . . . . . . . . . . . 7.476 7.098 7.854 . . . 87 . N . 87 . HN parsed_2m3c 1
61 . . . . . . . . . . . . . . . . 11.188 10.858 11.518 . . . 88 . N . 88 . HN parsed_2m3c 1
62 . . . . . . . . . . . . . . . . 4.322 3.925 4.719 . . . 89 . N . 89 . HN parsed_2m3c 1
63 . . . . . . . . . . . . . . . . -4.268 -4.998 -3.538 . . . 90 . N . 90 . HN parsed_2m3c 1
64 . . . . . . . . . . . . . . . . 11.790 11.301 12.279 . . . 91 . N . 91 . HN parsed_2m3c 1
65 . . . . . . . . . . . . . . . . 2.004 1.186 2.822 . . . 93 . N . 93 . HN parsed_2m3c 1
66 . . . . . . . . . . . . . . . . -22.478 -23.012 -21.944 . . . 94 . N . 94 . HN parsed_2m3c 1
67 . . . . . . . . . . . . . . . . 8.950 8.621 9.279 . . . 96 . N . 96 . HN parsed_2m3c 1
68 . . . . . . . . . . . . . . . . 6.744 5.887 7.601 . . . 97 . N . 97 . HN parsed_2m3c 1
69 . . . . . . . . . . . . . . . . -30.426 -31.636 -29.216 . . . 98 . N . 98 . HN parsed_2m3c 1
70 . . . . . . . . . . . . . . . . -12.322 -13.109 -11.535 . . . 99 . N . 99 . HN parsed_2m3c 1
71 . . . . . . . . . . . . . . . . -10.106 -10.515 -9.697 . . . 100 . N . 100 . HN parsed_2m3c 1
72 . . . . . . . . . . . . . . . . -7.938 -8.302 -7.574 . . . 101 . N . 101 . HN parsed_2m3c 1
73 . . . . . . . . . . . . . . . . -23.568 -24.026 -23.110 . . . 103 . N . 103 . HN parsed_2m3c 1
74 . . . . . . . . . . . . . . . . -7.268 -8.019 -6.517 . . . 104 . N . 104 . HN parsed_2m3c 1
75 . . . . . . . . . . . . . . . . -11.302 -11.629 -10.975 . . . 105 . N . 105 . HN parsed_2m3c 1
76 . . . . . . . . . . . . . . . . 14.150 13.539 14.761 . . . 106 . N . 106 . HN parsed_2m3c 1
77 . . . . . . . . . . . . . . . . 4.120 3.303 4.937 . . . 107 . N . 107 . HN parsed_2m3c 1
78 . . . . . . . . . . . . . . . . 9.008 8.702 9.314 . . . 109 . N . 109 . HN parsed_2m3c 1
79 . . . . . . . . . . . . . . . . -4.716 -5.155 -4.277 . . . 110 . N . 110 . HN parsed_2m3c 1
80 . . . . . . . . . . . . . . . . 5.088 4.869 5.307 . . . 112 . N . 112 . HN parsed_2m3c 1
81 . . . . . . . . . . . . . . . . -16.808 -17.516 -16.100 . . . 113 . N . 113 . HN parsed_2m3c 1
82 . . . . . . . . . . . . . . . . -25.728 -26.195 -25.261 . . . 114 . N . 114 . HN parsed_2m3c 1
83 . . . . . . . . . . . . . . . . -32.396 -32.794 -31.998 . . . 115 . N . 115 . HN parsed_2m3c 1
84 . . . . . . . . . . . . . . . . -19.410 -19.778 -19.042 . . . 116 . N . 116 . HN parsed_2m3c 1
85 . . . . . . . . . . . . . . . . -21.818 -22.357 -21.279 . . . 117 . N . 117 . HN parsed_2m3c 1
86 . . . . . . . . . . . . . . . . -12.440 -12.845 -12.035 . . . 118 . N . 118 . HN parsed_2m3c 1
87 . . . . . . . . . . . . . . . . -7.068 -7.330 -6.806 . . . 119 . N . 119 . HN parsed_2m3c 1
88 . . . . . . . . . . . . . . . . -2.618 -2.971 -2.265 . . . 120 . N . 120 . HN parsed_2m3c 1
89 . . . . . . . . . . . . . . . . -25.914 -26.429 -25.399 . . . 121 . N . 121 . HN parsed_2m3c 1
90 . . . . . . . . . . . . . . . . -23.436 -24.299 -22.573 . . . 122 . N . 122 . HN parsed_2m3c 1
91 . . . . . . . . . . . . . . . . -28.906 -29.799 -28.013 . . . 123 . N . 123 . HN parsed_2m3c 1
92 . . . . . . . . . . . . . . . . 7.824 7.529 8.119 . . . 124 . N . 124 . HN parsed_2m3c 1
93 . . . . . . . . . . . . . . . . 11.756 10.934 12.578 . . . 125 . N . 125 . HN parsed_2m3c 1
94 . . . . . . . . . . . . . . . . 10.430 9.749 11.111 . . . 126 . N . 126 . HN parsed_2m3c 1
95 . . . . . . . . . . . . . . . . 9.976 9.174 10.778 . . . 127 . N . 127 . HN parsed_2m3c 1
96 . . . . . . . . . . . . . . . . 17.448 16.534 18.362 . . . 128 . N . 128 . HN parsed_2m3c 1
97 . . . . . . . . . . . . . . . . 16.060 15.710 16.410 . . . 129 . N . 129 . HN parsed_2m3c 1
98 . . . . . . . . . . . . . . . . 6.768 6.076 7.460 . . . 131 . N . 131 . HN parsed_2m3c 1
99 . . . . . . . . . . . . . . . . 15.190 14.628 15.752 . . . 132 . N . 132 . HN parsed_2m3c 1
100 . . . . . . . . . . . . . . . . 7.708 7.118 8.298 . . . 133 . N . 133 . HN parsed_2m3c 1
101 . . . . . . . . . . . . . . . . -1.144 -1.633 -0.655 . . . 134 . N . 134 . HN parsed_2m3c 1
102 . . . . . . . . . . . . . . . . -17.032 -17.629 -16.435 . . . 135 . N . 135 . HN parsed_2m3c 1
103 . . . . . . . . . . . . . . . . -22.544 -23.251 -21.837 . . . 139 . N . 139 . HN parsed_2m3c 1
104 . . . . . . . . . . . . . . . . -29.026 -29.571 -28.481 . . . 140 . N . 140 . HN parsed_2m3c 1
105 . . . . . . . . . . . . . . . . -32.296 -32.621 -31.971 . . . 141 . N . 141 . HN parsed_2m3c 1
106 . . . . . . . . . . . . . . . . -22.704 -23.020 -22.388 . . . 142 . N . 142 . HN parsed_2m3c 1
107 . . . . . . . . . . . . . . . . 1.192 0.774 1.610 . . . 143 . N . 143 . HN parsed_2m3c 1
108 . . . . . . . . . . . . . . . . -24.676 -25.388 -23.964 . . . 144 . N . 144 . HN parsed_2m3c 1
109 . . . . . . . . . . . . . . . . -2.758 -3.265 -2.251 . . . 145 . N . 145 . HN parsed_2m3c 1
110 . . . . . . . . . . . . . . . . 9.880 9.444 10.316 . . . 148 . N . 148 . HN parsed_2m3c 1
111 . . . . . . . . . . . . . . . . -3.256 -3.789 -2.723 . . . 150 . N . 150 . HN parsed_2m3c 1
112 . . . . . . . . . . . . . . . . -1.426 -1.972 -0.880 . . . 152 . N . 152 . HN parsed_2m3c 1
113 . . . . . . . . . . . . . . . . -19.100 -19.522 -18.678 . . . 154 . N . 154 . HN parsed_2m3c 1
114 . . . . . . . . . . . . . . . . -14.302 -14.796 -13.808 . . . 155 . N . 155 . HN parsed_2m3c 1
115 . . . . . . . . . . . . . . . . -26.002 -26.379 -25.625 . . . 156 . N . 156 . HN parsed_2m3c 1
116 . . . . . . . . . . . . . . . . -3.484 -3.955 -3.013 . . . 159 . N . 159 . HN parsed_2m3c 1
117 . . . . . . . . . . . . . . . . -5.316 -6.033 -4.599 . . . 160 . N . 160 . HN parsed_2m3c 1
118 . . . . . . . . . . . . . . . . 11.722 10.762 12.682 . . . 161 . N . 161 . HN parsed_2m3c 1
119 . . . . . . . . . . . . . . . . 20.234 19.737 20.731 . . . 163 . N . 163 . HN parsed_2m3c 1
120 . . . . . . . . . . . . . . . . 2.146 1.841 2.451 . . . 164 . N . 164 . HN parsed_2m3c 1
121 . . . . . . . . . . . . . . . . -23.904 -24.573 -23.235 . . . 165 . N . 165 . HN parsed_2m3c 1
122 . . . . . . . . . . . . . . . . -24.510 -25.446 -23.574 . . . 166 . N . 166 . HN parsed_2m3c 1
123 . . . . . . . . . . . . . . . . 0.176 -0.196 0.548 . . . 167 . N . 167 . HN parsed_2m3c 1
124 . . . . . . . . . . . . . . . . 5.944 5.499 6.389 . . . 169 . N . 169 . HN parsed_2m3c 1
125 . . . . . . . . . . . . . . . . 11.126 10.524 11.728 . . . 170 . N . 170 . HN parsed_2m3c 1
126 . . . . . . . . . . . . . . . . 3.724 3.075 4.373 . . . 171 . N . 171 . HN parsed_2m3c 1
127 . . . . . . . . . . . . . . . . 17.104 16.744 17.464 . . . 172 . N . 172 . HN parsed_2m3c 1
128 . . . . . . . . . . . . . . . . 4.458 4.362 4.554 . . . 174 . N . 174 . HN parsed_2m3c 1
129 . . . . . . . . . . . . . . . . 13.532 12.682 14.382 . . . 147 . N . 147 . HN parsed_2m3c 1
130 . . . . . . . . . . . . . . . . 18.978 18.391 19.565 . . . 24 . N . 24 . HN parsed_2m3c 1
131 . . . . . . . . . . . . . . . . -6.000 -6.541 -5.459 . . . 82 . N . 82 . HN parsed_2m3c 1
stop_
save_
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