NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
51087 |
2k5b   |
cing | 2-parsed | STAR | dipolar coupling | 77 |
data_2k5b_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2k5b
_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_2k5b 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2k5b
_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 2k5b "Master copy" parsed_2k5b
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2k5b
_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 2k5b.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2k5b 1
1 2k5b.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 18 parsed_2k5b 1
1 2k5b.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 77 parsed_2k5b 1
1 2k5b.mr . . HADDOCK 4 distance NOE ambi 0 parsed_2k5b 1
1 2k5b.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2k5b 1
1 2k5b.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2k5b 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2k5b
_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 . . . . . . . . . . . . . . . . -11.70 . . . . B 149 . N B 149 . HN parsed_2k5b 1
2 . . . . . . . . . . . . . . . . 6.10 . . . . B 157 . N B 157 . HN parsed_2k5b 1
3 . . . . . . . . . . . . . . . . -3.62 . . . . B 163 . N B 163 . HN parsed_2k5b 1
4 . . . . . . . . . . . . . . . . -7.02 . . . . B 169 . N B 169 . HN parsed_2k5b 1
5 . . . . . . . . . . . . . . . . -6.53 . . . . B 176 . N B 176 . HN parsed_2k5b 1
6 . . . . . . . . . . . . . . . . 9.87 . . . . B 178 . N B 178 . HN parsed_2k5b 1
7 . . . . . . . . . . . . . . . . 6.33 . . . . B 185 . N B 185 . HN parsed_2k5b 1
8 . . . . . . . . . . . . . . . . 9.05 . . . . B 188 . N B 188 . HN parsed_2k5b 1
9 . . . . . . . . . . . . . . . . 2.92 . . . . B 194 . N B 194 . HN parsed_2k5b 1
10 . . . . . . . . . . . . . . . . 4.48 . . . . B 204 . N B 204 . HN parsed_2k5b 1
11 . . . . . . . . . . . . . . . . 6.32 . . . . B 210 . N B 210 . HN parsed_2k5b 1
12 . . . . . . . . . . . . . . . . -2.84 . . . . B 218 . N B 218 . HN parsed_2k5b 1
13 . . . . . . . . . . . . . . . . -0.93 . . . . B 222 . N B 222 . HN parsed_2k5b 1
14 . . . . . . . . . . . . . . . . -2.84 . . . . B 225 . N B 225 . HN parsed_2k5b 1
15 . . . . . . . . . . . . . . . . 7.80 . . . . B 228 . N B 228 . HN parsed_2k5b 1
16 . . . . . . . . . . . . . . . . 9.65 . . . . B 229 . N B 229 . HN parsed_2k5b 1
17 . . . . . . . . . . . . . . . . -13.63 . . . . B 231 . N B 231 . HN parsed_2k5b 1
18 . . . . . . . . . . . . . . . . -9.80 . . . . B 233 . N B 233 . HN parsed_2k5b 1
19 . . . . . . . . . . . . . . . . 2.67 . . . . B 243 . N B 243 . HN parsed_2k5b 1
20 . . . . . . . . . . . . . . . . 8.29 . . . . B 244 . N B 244 . HN parsed_2k5b 1
21 . . . . . . . . . . . . . . . . 1.42 . . . . B 250 . N B 250 . HN parsed_2k5b 1
22 . . . . . . . . . . . . . . . . -3.69 . . . . B 251 . N B 251 . HN parsed_2k5b 1
23 . . . . . . . . . . . . . . . . -8.87 . . . . B 252 . N B 252 . HN parsed_2k5b 1
24 . . . . . . . . . . . . . . . . -8.59 . . . . B 253 . N B 253 . HN parsed_2k5b 1
25 . . . . . . . . . . . . . . . . -0.65 . . . . B 257 . N B 257 . HN parsed_2k5b 1
26 . . . . . . . . . . . . . . . . 18.52 . . . . A 42 . N A 42 . HN parsed_2k5b 1
27 . . . . . . . . . . . . . . . . 1.56 . . . . A 53 . N A 53 . HN parsed_2k5b 1
28 . . . . . . . . . . . . . . . . 5.96 . . . . A 56 . N A 56 . HN parsed_2k5b 1
29 . . . . . . . . . . . . . . . . 9.08 . . . . A 57 . N A 57 . HN parsed_2k5b 1
30 . . . . . . . . . . . . . . . . 13.20 . . . . A 60 . N A 60 . HN parsed_2k5b 1
31 . . . . . . . . . . . . . . . . 3.26 . . . . A 61 . N A 61 . HN parsed_2k5b 1
32 . . . . . . . . . . . . . . . . -3.70 . . . . A 68 . N A 68 . HN parsed_2k5b 1
33 . . . . . . . . . . . . . . . . -16.03 . . . . A 72 . N A 72 . HN parsed_2k5b 1
34 . . . . . . . . . . . . . . . . 15.62 . . . . A 79 . N A 79 . HN parsed_2k5b 1
35 . . . . . . . . . . . . . . . . 9.29 . . . . A 80 . N A 80 . HN parsed_2k5b 1
36 . . . . . . . . . . . . . . . . -7.30 . . . . A 83 . N A 83 . HN parsed_2k5b 1
37 . . . . . . . . . . . . . . . . 15.11 . . . . A 91 . N A 91 . HN parsed_2k5b 1
38 . . . . . . . . . . . . . . . . 17.24 . . . . A 92 . N A 92 . HN parsed_2k5b 1
39 . . . . . . . . . . . . . . . . 10.57 . . . . A 93 . N A 93 . HN parsed_2k5b 1
40 . . . . . . . . . . . . . . . . 3.90 . . . . A 95 . N A 95 . HN parsed_2k5b 1
41 . . . . . . . . . . . . . . . . -24.70 . . . . A 96 . N A 96 . HN parsed_2k5b 1
42 . . . . . . . . . . . . . . . . 4.12 . . . . A 137 . N A 137 . HN parsed_2k5b 1
43 . . . . . . . . . . . . . . . . 12.78 . . . . A 144 . N A 144 . HN parsed_2k5b 1
44 . . . . . . . . . . . . . . . . 11.14 . . . . A 149 . N A 149 . HN parsed_2k5b 1
45 . . . . . . . . . . . . . . . . 12.56 . . . . A 150 . N A 150 . HN parsed_2k5b 1
46 . . . . . . . . . . . . . . . . 12.64 . . . . A 151 . N A 151 . HN parsed_2k5b 1
47 . . . . . . . . . . . . . . . . 11.84 . . . . A 152 . N A 152 . HN parsed_2k5b 1
48 . . . . . . . . . . . . . . . . 4.90 . . . . A 157 . N A 157 . HN parsed_2k5b 1
49 . . . . . . . . . . . . . . . . 4.62 . . . . A 158 . N A 158 . HN parsed_2k5b 1
50 . . . . . . . . . . . . . . . . 14.05 . . . . A 163 . N A 163 . HN parsed_2k5b 1
51 . . . . . . . . . . . . . . . . 16.03 . . . . A 164 . N A 164 . HN parsed_2k5b 1
52 . . . . . . . . . . . . . . . . 11.71 . . . . A 170 . N A 170 . HN parsed_2k5b 1
53 . . . . . . . . . . . . . . . . 18.17 . . . . A 171 . N A 171 . HN parsed_2k5b 1
54 . . . . . . . . . . . . . . . . -15.75 . . . . A 175 . N A 175 . HN parsed_2k5b 1
55 . . . . . . . . . . . . . . . . 8.74 . . . . A 178 . N A 178 . HN parsed_2k5b 1
56 . . . . . . . . . . . . . . . . 11.13 . . . . A 180 . N A 180 . HN parsed_2k5b 1
57 . . . . . . . . . . . . . . . . 6.46 . . . . A 181 . N A 181 . HN parsed_2k5b 1
58 . . . . . . . . . . . . . . . . 12.42 . . . . A 182 . N A 182 . HN parsed_2k5b 1
59 . . . . . . . . . . . . . . . . 7.59 . . . . A 183 . N A 183 . HN parsed_2k5b 1
60 . . . . . . . . . . . . . . . . 9.43 . . . . A 186 . N A 186 . HN parsed_2k5b 1
61 . . . . . . . . . . . . . . . . 12.14 . . . . A 188 . N A 188 . HN parsed_2k5b 1
62 . . . . . . . . . . . . . . . . 3.70 . . . . A 189 . N A 189 . HN parsed_2k5b 1
63 . . . . . . . . . . . . . . . . -0.79 . . . . A 190 . N A 190 . HN parsed_2k5b 1
64 . . . . . . . . . . . . . . . . 9.22 . . . . A 192 . N A 192 . HN parsed_2k5b 1
65 . . . . . . . . . . . . . . . . 5.67 . . . . A 193 . N A 193 . HN parsed_2k5b 1
66 . . . . . . . . . . . . . . . . 11.07 . . . . A 195 . N A 195 . HN parsed_2k5b 1
67 . . . . . . . . . . . . . . . . 2.48 . . . . A 196 . N A 196 . HN parsed_2k5b 1
68 . . . . . . . . . . . . . . . . 6.53 . . . . A 197 . N A 197 . HN parsed_2k5b 1
69 . . . . . . . . . . . . . . . . -11.00 . . . . A 201 . N A 201 . HN parsed_2k5b 1
70 . . . . . . . . . . . . . . . . -21.35 . . . . A 202 . N A 202 . HN parsed_2k5b 1
71 . . . . . . . . . . . . . . . . -10.57 . . . . A 204 . N A 204 . HN parsed_2k5b 1
72 . . . . . . . . . . . . . . . . 5.24 . . . . A 211 . N A 211 . HN parsed_2k5b 1
73 . . . . . . . . . . . . . . . . 7.31 . . . . A 216 . N A 216 . HN parsed_2k5b 1
74 . . . . . . . . . . . . . . . . 9.58 . . . . A 218 . N A 218 . HN parsed_2k5b 1
75 . . . . . . . . . . . . . . . . 10.85 . . . . A 220 . N A 220 . HN parsed_2k5b 1
76 . . . . . . . . . . . . . . . . 6.03 . . . . A 221 . N A 221 . HN parsed_2k5b 1
77 . . . . . . . . . . . . . . . . -1.16 . . . . A 223 . N A 223 . HN parsed_2k5b 1
stop_
save_
Contact the webmaster for help, if required. Monday, April 29, 2024 2:10:49 AM GMT (wattos1)