NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
613933 |
5lnf   |
34030 | cing | 2-parsed | STAR | dipolar coupling | 136 |
data_5lnf_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5lnf
_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_5lnf 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5lnf
_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 5lnf "Master copy" parsed_5lnf
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5lnf
_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 5lnf.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5lnf 1
1 5lnf.mr . . XPLOR/CNS 2 distance NOE simple 3728 parsed_5lnf 1
1 5lnf.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 187 parsed_5lnf 1
1 5lnf.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 136 parsed_5lnf 1
1 5lnf.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5lnf 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_5lnf
_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 . . . . . . . . . . . . . . . . 4.008 . . . . " A" 187 . N " A" 187 . HN parsed_5lnf 1
2 . . . . . . . . . . . . . . . . -11.212 . . . . " A" 193 . N " A" 193 . HN parsed_5lnf 1
3 . . . . . . . . . . . . . . . . -6.646 . . . . " A" 194 . N " A" 194 . HN parsed_5lnf 1
4 . . . . . . . . . . . . . . . . -8.286 . . . . " A" 203 . N " A" 203 . HN parsed_5lnf 1
5 . . . . . . . . . . . . . . . . -11.615 . . . . " A" 205 . N " A" 205 . HN parsed_5lnf 1
6 . . . . . . . . . . . . . . . . -2.13 . . . . " A" 207 . N " A" 207 . HN parsed_5lnf 1
7 . . . . . . . . . . . . . . . . 4.613 . . . . " A" 210 . N " A" 210 . HN parsed_5lnf 1
8 . . . . . . . . . . . . . . . . -4.164 . . . . " A" 213 . N " A" 213 . HN parsed_5lnf 1
9 . . . . . . . . . . . . . . . . -8.535 . . . . " A" 214 . N " A" 214 . HN parsed_5lnf 1
10 . . . . . . . . . . . . . . . . -9.159 . . . . " A" 216 . N " A" 216 . HN parsed_5lnf 1
11 . . . . . . . . . . . . . . . . -1.825 . . . . " A" 217 . N " A" 217 . HN parsed_5lnf 1
12 . . . . . . . . . . . . . . . . -12.244 . . . . " A" 222 . N " A" 222 . HN parsed_5lnf 1
13 . . . . . . . . . . . . . . . . -8.271 . . . . " A" 223 . N " A" 223 . HN parsed_5lnf 1
14 . . . . . . . . . . . . . . . . -7.174 . . . . " A" 225 . N " A" 225 . HN parsed_5lnf 1
15 . . . . . . . . . . . . . . . . -13.425 . . . . " A" 226 . N " A" 226 . HN parsed_5lnf 1
16 . . . . . . . . . . . . . . . . 0.218 . . . . " A" 231 . N " A" 231 . HN parsed_5lnf 1
17 . . . . . . . . . . . . . . . . 1.945 . . . . " A" 234 . N " A" 234 . HN parsed_5lnf 1
18 . . . . . . . . . . . . . . . . -0.38 . . . . " A" 236 . N " A" 236 . HN parsed_5lnf 1
19 . . . . . . . . . . . . . . . . -8.929 . . . . " A" 238 . N " A" 238 . HN parsed_5lnf 1
20 . . . . . . . . . . . . . . . . 1.738 . . . . " A" 239 . N " A" 239 . HN parsed_5lnf 1
21 . . . . . . . . . . . . . . . . 2.766 . . . . " A" 240 . N " A" 240 . HN parsed_5lnf 1
22 . . . . . . . . . . . . . . . . -6.007 . . . . " A" 241 . N " A" 241 . HN parsed_5lnf 1
23 . . . . . . . . . . . . . . . . 2.758 . . . . " A" 242 . N " A" 242 . HN parsed_5lnf 1
24 . . . . . . . . . . . . . . . . -5.531 . . . . " A" 255 . N " A" 255 . HN parsed_5lnf 1
25 . . . . . . . . . . . . . . . . -9.616 . . . . " A" 262 . N " A" 262 . HN parsed_5lnf 1
26 . . . . . . . . . . . . . . . . -7.317 . . . . " A" 266 . N " A" 266 . HN parsed_5lnf 1
27 . . . . . . . . . . . . . . . . -5.271 . . . . " A" 268 . N " A" 268 . HN parsed_5lnf 1
28 . . . . . . . . . . . . . . . . -2.115 . . . . " A" 269 . N " A" 269 . HN parsed_5lnf 1
29 . . . . . . . . . . . . . . . . -6.99952 . . . . " A" 179 . C " A" 180 . N parsed_5lnf 1
30 . . . . . . . . . . . . . . . . -0.47724 . . . . " A" 185 . C " A" 186 . N parsed_5lnf 1
31 . . . . . . . . . . . . . . . . 4.93148 . . . . " A" 186 . C " A" 187 . N parsed_5lnf 1
32 . . . . . . . . . . . . . . . . -3.73838 . . . . " A" 194 . C " A" 195 . N parsed_5lnf 1
33 . . . . . . . . . . . . . . . . 1.11356 . . . . " A" 198 . C " A" 199 . N parsed_5lnf 1
34 . . . . . . . . . . . . . . . . 6.3632 . . . . " A" 202 . C " A" 203 . N parsed_5lnf 1
35 . . . . . . . . . . . . . . . . 1.82942 . . . . " A" 203 . C " A" 204 . N parsed_5lnf 1
36 . . . . . . . . . . . . . . . . 6.99952 . . . . " A" 204 . C " A" 205 . N parsed_5lnf 1
37 . . . . . . . . . . . . . . . . -0.87494 . . . . " A" 205 . C " A" 206 . N parsed_5lnf 1
38 . . . . . . . . . . . . . . . . 9.22664 . . . . " A" 206 . C " A" 207 . N parsed_5lnf 1
39 . . . . . . . . . . . . . . . . -3.81792 . . . . " A" 207 . C " A" 208 . N parsed_5lnf 1
40 . . . . . . . . . . . . . . . . -4.29516 . . . . " A" 208 . C " A" 209 . N parsed_5lnf 1
41 . . . . . . . . . . . . . . . . 3.1816 . . . . " A" 212 . C " A" 213 . N parsed_5lnf 1
42 . . . . . . . . . . . . . . . . 8.11308 . . . . " A" 213 . C " A" 214 . N parsed_5lnf 1
43 . . . . . . . . . . . . . . . . -1.5908 . . . . " A" 214 . C " A" 215 . N parsed_5lnf 1
44 . . . . . . . . . . . . . . . . -1.11356 . . . . " A" 215 . C " A" 216 . N parsed_5lnf 1
45 . . . . . . . . . . . . . . . . 4.45424 . . . . " A" 216 . C " A" 217 . N parsed_5lnf 1
46 . . . . . . . . . . . . . . . . 0.63632 . . . . " A" 217 . C " A" 218 . N parsed_5lnf 1
47 . . . . . . . . . . . . . . . . 5.80642 . . . . " A" 218 . C " A" 219 . N parsed_5lnf 1
48 . . . . . . . . . . . . . . . . -0.55678 . . . . " A" 219 . C " A" 220 . N parsed_5lnf 1
49 . . . . . . . . . . . . . . . . -3.10206 . . . . " A" 221 . C " A" 222 . N parsed_5lnf 1
50 . . . . . . . . . . . . . . . . 0.15908 . . . . " A" 222 . C " A" 223 . N parsed_5lnf 1
51 . . . . . . . . . . . . . . . . 6.12458 . . . . " A" 223 . C " A" 224 . N parsed_5lnf 1
52 . . . . . . . . . . . . . . . . 5.72688 . . . . " A" 224 . C " A" 225 . N parsed_5lnf 1
53 . . . . . . . . . . . . . . . . 0 . . . . " A" 225 . C " A" 226 . N parsed_5lnf 1
54 . . . . . . . . . . . . . . . . -1.1931 . . . . " A" 226 . C " A" 227 . N parsed_5lnf 1
55 . . . . . . . . . . . . . . . . -0.07954 . . . . " A" 228 . C " A" 229 . N parsed_5lnf 1
56 . . . . . . . . . . . . . . . . 12.6469 . . . . " A" 231 . C " A" 232 . N parsed_5lnf 1
57 . . . . . . . . . . . . . . . . 0.55678 . . . . " A" 233 . C " A" 234 . N parsed_5lnf 1
58 . . . . . . . . . . . . . . . . 4.05654 . . . . " A" 234 . C " A" 235 . N parsed_5lnf 1
59 . . . . . . . . . . . . . . . . -5.01102 . . . . " A" 235 . C " A" 236 . N parsed_5lnf 1
60 . . . . . . . . . . . . . . . . 5.48826 . . . . " A" 237 . C " A" 238 . N parsed_5lnf 1
61 . . . . . . . . . . . . . . . . 3.65884 . . . . " A" 239 . C " A" 240 . N parsed_5lnf 1
62 . . . . . . . . . . . . . . . . -2.22712 . . . . " A" 242 . C " A" 243 . N parsed_5lnf 1
63 . . . . . . . . . . . . . . . . -6.28366 . . . . " A" 243 . C " A" 244 . N parsed_5lnf 1
64 . . . . . . . . . . . . . . . . 12.1696 . . . . " A" 245 . C " A" 246 . N parsed_5lnf 1
65 . . . . . . . . . . . . . . . . -1.5908 . . . . " A" 246 . C " A" 247 . N parsed_5lnf 1
66 . . . . . . . . . . . . . . . . 5.09056 . . . . " A" 249 . C " A" 250 . N parsed_5lnf 1
67 . . . . . . . . . . . . . . . . -0.23862 . . . . " A" 250 . C " A" 251 . N parsed_5lnf 1
68 . . . . . . . . . . . . . . . . 0.71586 . . . . " A" 253 . C " A" 254 . N parsed_5lnf 1
69 . . . . . . . . . . . . . . . . -2.3862 . . . . " A" 254 . C " A" 255 . N parsed_5lnf 1
70 . . . . . . . . . . . . . . . . 1.51126 . . . . " A" 255 . C " A" 256 . N parsed_5lnf 1
71 . . . . . . . . . . . . . . . . 4.7724 . . . . " A" 256 . C " A" 257 . N parsed_5lnf 1
72 . . . . . . . . . . . . . . . . 6.12458 . . . . " A" 259 . C " A" 260 . N parsed_5lnf 1
73 . . . . . . . . . . . . . . . . -0.95448 . . . . " A" 260 . C " A" 261 . N parsed_5lnf 1
74 . . . . . . . . . . . . . . . . 2.7839 . . . . " A" 261 . C " A" 262 . N parsed_5lnf 1
75 . . . . . . . . . . . . . . . . 14.874 . . . . " A" 262 . C " A" 263 . N parsed_5lnf 1
76 . . . . . . . . . . . . . . . . 14.874 . . . . " A" 265 . C " A" 266 . N parsed_5lnf 1
77 . . . . . . . . . . . . . . . . 0.95448 . . . . " A" 270 . C " A" 271 . N parsed_5lnf 1
78 . . . . . . . . . . . . . . . . 0.23862 . . . . " A" 277 . C " A" 278 . N parsed_5lnf 1
79 . . . . . . . . . . . . . . . . 4.61332 . . . . " A" 280 . C " A" 281 . N parsed_5lnf 1
80 . . . . . . . . . . . . . . . . 2.54528 . . . . " A" 281 . C " A" 282 . N parsed_5lnf 1
81 . . . . . . . . . . . . . . . . 7.39722 . . . . " A" 282 . C " A" 283 . N parsed_5lnf 1
82 . . . . . . . . . . . . . . . . 1.82942 . . . . " A" 289 . C " A" 290 . N parsed_5lnf 1
83 . . . . . . . . . . . . . . . . 4.45424 . . . . " A" 290 . C " A" 291 . N parsed_5lnf 1
84 . . . . . . . . . . . . . . . . -6.44274 . . . . " A" 297 . C " A" 298 . N parsed_5lnf 1
85 . . . . . . . . . . . . . . . . 1.74988 . . . . " A" 298 . C " A" 299 . N parsed_5lnf 1
86 . . . . . . . . . . . . . . . . -4.74555 . . . . " A" 183 . C " A" 184 . HN parsed_5lnf 1
87 . . . . . . . . . . . . . . . . -3.3158 . . . . " A" 194 . C " A" 195 . HN parsed_5lnf 1
88 . . . . . . . . . . . . . . . . -3.22454 . . . . " A" 198 . C " A" 199 . HN parsed_5lnf 1
89 . . . . . . . . . . . . . . . . -10.9208 . . . . " A" 201 . C " A" 202 . HN parsed_5lnf 1
90 . . . . . . . . . . . . . . . . -5.29311 . . . . " A" 203 . C " A" 204 . HN parsed_5lnf 1
91 . . . . . . . . . . . . . . . . -5.62774 . . . . " A" 204 . C " A" 205 . HN parsed_5lnf 1
92 . . . . . . . . . . . . . . . . -3.4679 . . . . " A" 205 . C " A" 206 . HN parsed_5lnf 1
93 . . . . . . . . . . . . . . . . 4.19799 . . . . " A" 206 . C " A" 207 . HN parsed_5lnf 1
94 . . . . . . . . . . . . . . . . -4.38051 . . . . " A" 208 . C " A" 209 . HN parsed_5lnf 1
95 . . . . . . . . . . . . . . . . -0.486723 . . . . " A" 213 . C " A" 214 . HN parsed_5lnf 1
96 . . . . . . . . . . . . . . . . -4.38051 . . . . " A" 215 . C " A" 216 . HN parsed_5lnf 1
97 . . . . . . . . . . . . . . . . 3.1637 . . . . " A" 216 . C " A" 217 . HN parsed_5lnf 1
98 . . . . . . . . . . . . . . . . -7.84841 . . . . " A" 217 . C " A" 218 . HN parsed_5lnf 1
99 . . . . . . . . . . . . . . . . -6.6316 . . . . " A" 218 . C " A" 219 . HN parsed_5lnf 1
100 . . . . . . . . . . . . . . . . -12.959 . . . . " A" 221 . C " A" 222 . HN parsed_5lnf 1
101 . . . . . . . . . . . . . . . . -1.42975 . . . . " A" 222 . C " A" 223 . HN parsed_5lnf 1
102 . . . . . . . . . . . . . . . . -0.304202 . . . . " A" 223 . C " A" 224 . HN parsed_5lnf 1
103 . . . . . . . . . . . . . . . . 4.74555 . . . . " A" 224 . C " A" 225 . HN parsed_5lnf 1
104 . . . . . . . . . . . . . . . . -5.99278 . . . . " A" 225 . C " A" 226 . HN parsed_5lnf 1
105 . . . . . . . . . . . . . . . . -2.34235 . . . . " A" 226 . C " A" 227 . HN parsed_5lnf 1
106 . . . . . . . . . . . . . . . . -8.66975 . . . . " A" 228 . C " A" 229 . HN parsed_5lnf 1
107 . . . . . . . . . . . . . . . . 1.18639 . . . . " A" 230 . C " A" 231 . HN parsed_5lnf 1
108 . . . . . . . . . . . . . . . . 8.33513 . . . . " A" 231 . C " A" 232 . HN parsed_5lnf 1
109 . . . . . . . . . . . . . . . . 0.243362 . . . . " A" 233 . C " A" 234 . HN parsed_5lnf 1
110 . . . . . . . . . . . . . . . . 14.9667 . . . . " A" 234 . C " A" 235 . HN parsed_5lnf 1
111 . . . . . . . . . . . . . . . . 1.61227 . . . . " A" 235 . C " A" 236 . HN parsed_5lnf 1
112 . . . . . . . . . . . . . . . . 2.73782 . . . . " A" 237 . C " A" 238 . HN parsed_5lnf 1
113 . . . . . . . . . . . . . . . . 5.01933 . . . . " A" 239 . C " A" 240 . HN parsed_5lnf 1
114 . . . . . . . . . . . . . . . . -7.97009 . . . . " A" 242 . C " A" 243 . HN parsed_5lnf 1
115 . . . . . . . . . . . . . . . . -10.1908 . . . . " A" 243 . C " A" 244 . HN parsed_5lnf 1
116 . . . . . . . . . . . . . . . . 2.8595 . . . . " A" 244 . C " A" 245 . HN parsed_5lnf 1
117 . . . . . . . . . . . . . . . . 7.93967 . . . . " A" 245 . C " A" 246 . HN parsed_5lnf 1
118 . . . . . . . . . . . . . . . . -4.86723 . . . . " A" 246 . C " A" 247 . HN parsed_5lnf 1
119 . . . . . . . . . . . . . . . . 4.98891 . . . . " A" 249 . C " A" 250 . HN parsed_5lnf 1
120 . . . . . . . . . . . . . . . . 12.2593 . . . . " A" 252 . C " A" 253 . HN parsed_5lnf 1
121 . . . . . . . . . . . . . . . . 2.8595 . . . . " A" 255 . C " A" 256 . HN parsed_5lnf 1
122 . . . . . . . . . . . . . . . . 11.438 . . . . " A" 256 . C " A" 257 . HN parsed_5lnf 1
123 . . . . . . . . . . . . . . . . -9.82572 . . . . " A" 258 . C " A" 259 . HN parsed_5lnf 1
124 . . . . . . . . . . . . . . . . -3.58958 . . . . " A" 260 . C " A" 261 . HN parsed_5lnf 1
125 . . . . . . . . . . . . . . . . -10.3733 . . . . " A" 261 . C " A" 262 . HN parsed_5lnf 1
126 . . . . . . . . . . . . . . . . 12.8373 . . . . " A" 262 . C " A" 263 . HN parsed_5lnf 1
127 . . . . . . . . . . . . . . . . 6.4795 . . . . " A" 265 . C " A" 266 . HN parsed_5lnf 1
128 . . . . . . . . . . . . . . . . -10.495 . . . . " A" 266 . C " A" 267 . HN parsed_5lnf 1
129 . . . . . . . . . . . . . . . . -2.43362 . . . . " A" 275 . C " A" 276 . HN parsed_5lnf 1
130 . . . . . . . . . . . . . . . . 0.973446 . . . . " A" 276 . C " A" 277 . HN parsed_5lnf 1
131 . . . . . . . . . . . . . . . . 2.58572 . . . . " A" 280 . C " A" 281 . HN parsed_5lnf 1
132 . . . . . . . . . . . . . . . . -5.14101 . . . . " A" 282 . C " A" 283 . HN parsed_5lnf 1
133 . . . . . . . . . . . . . . . . 2.19025 . . . . " A" 289 . C " A" 290 . HN parsed_5lnf 1
134 . . . . . . . . . . . . . . . . 0.943026 . . . . " A" 290 . C " A" 291 . HN parsed_5lnf 1
135 . . . . . . . . . . . . . . . . -5.23227 . . . . " A" 297 . C " A" 298 . HN parsed_5lnf 1
136 . . . . . . . . . . . . . . . . 3.40706 . . . . " A" 298 . C " A" 299 . HN parsed_5lnf 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 3: rdc1.tbl" 1 1 1 29 parsed_5lnf 1
2 "# Restraints file 4: rdc2.tbl" 85 1 85 29 parsed_5lnf 1
3 "# Restraints file 5: rdc3.tbl" 256 1 256 29 parsed_5lnf 1
stop_
save_
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