NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
572105 |
2miy   |
19698 | cing | 2-parsed | STAR | dipolar coupling | 103 |
data_2miy_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2miy
_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_2miy 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2miy
_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 2miy "Master copy" parsed_2miy
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2miy
_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 2miy.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2miy 1
1 2miy.mr . . XPLOR/CNS 2 distance NOE simple 865 parsed_2miy 1
1 2miy.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 122 parsed_2miy 1
1 2miy.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 221 parsed_2miy 1
1 2miy.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 26 parsed_2miy 1
1 2miy.mr . . XPLOR/CNS 6 unknown "Not applicable" "Not applicable" 0 parsed_2miy 1
1 2miy.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 103 parsed_2miy 1
1 2miy.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2miy 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_7
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2miy
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 7
_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 . . . . . . . . . . . . . . . . 3.911 -1.202 9.024 . . . -1 . N1 . -1 . H1 parsed_2miy 1
2 . . . . . . . . . . . . . . . . 0.818 -4.295 5.931 . . . 2 . N3 . 2 . H3 parsed_2miy 1
3 . . . . . . . . . . . . . . . . 24.747 19.634 29.860 . . . 3 . N3 . 3 . H3 parsed_2miy 1
4 . . . . . . . . . . . . . . . . 29.937 24.824 35.050 . . . 4 . N1 . 4 . H1 parsed_2miy 1
5 . . . . . . . . . . . . . . . . 6.673 1.560 11.786 . . . 5 . N1 . 5 . H1 parsed_2miy 1
6 . . . . . . . . . . . . . . . . -8.360 -13.473 -3.247 . . . 6 . N3 . 6 . H3 parsed_2miy 1
7 . . . . . . . . . . . . . . . . -5.880 -10.993 -0.767 . . . 7 . N1 . 7 . H1 parsed_2miy 1
8 . . . . . . . . . . . . . . . . -0.358 -5.471 4.755 . . . 9 . N3 . 9 . H3 parsed_2miy 1
9 . . . . . . . . . . . . . . . . 25.156 20.043 30.269 . . . 10 . N3 . 10 . H3 parsed_2miy 1
10 . . . . . . . . . . . . . . . . 20.708 15.595 25.821 . . . 14 . N3 . 14 . H3 parsed_2miy 1
11 . . . . . . . . . . . . . . . . -7.465 -12.578 -2.352 . . . 15 . N3 . 15 . H3 parsed_2miy 1
12 . . . . . . . . . . . . . . . . -1.917 -7.030 3.196 . . . 17 . N3 . 17 . H3 parsed_2miy 1
13 . . . . . . . . . . . . . . . . 18.586 13.473 23.699 . . . 18 . N3 . 18 . H3 parsed_2miy 1
14 . . . . . . . . . . . . . . . . 26.153 21.040 31.266 . . . 19 . N3 . 19 . H3 parsed_2miy 1
15 . . . . . . . . . . . . . . . . -11.990 -17.103 -6.877 . . . 26 . N1 . 26 . H1 parsed_2miy 1
16 . . . . . . . . . . . . . . . . -13.575 -18.688 -8.462 . . . 53 . N1 . 53 . H1 parsed_2miy 1
17 . . . . . . . . . . . . . . . . -8.769 -13.882 -3.656 . . . 54 . N1 . 54 . H1 parsed_2miy 1
18 . . . . . . . . . . . . . . . . 36.175 31.062 41.288 . . . 56 . N1 . 56 . H1 parsed_2miy 1
19 . . . . . . . . . . . . . . . . 32.815 30.296 35.334 . . . 4 . C8 . 4 . H8 parsed_2miy 1
20 . . . . . . . . . . . . . . . . 26.731 24.212 29.250 . . . 5 . C8 . 5 . H8 parsed_2miy 1
21 . . . . . . . . . . . . . . . . -14.688 -17.207 -12.169 . . . 7 . C8 . 7 . H8 parsed_2miy 1
22 . . . . . . . . . . . . . . . . -4.812 -7.331 -2.293 . . . 8 . C6 . 8 . H6 parsed_2miy 1
23 . . . . . . . . . . . . . . . . 10.254 7.735 12.773 . . . 11 . C8 . 11 . H8 parsed_2miy 1
24 . . . . . . . . . . . . . . . . 2.608 0.089 5.127 . . . 12 . C8 . 12 . H8 parsed_2miy 1
25 . . . . . . . . . . . . . . . . 22.360 19.841 24.879 . . . 19 . C6 . 19 . H6 parsed_2miy 1
26 . . . . . . . . . . . . . . . . -12.156 -14.675 -9.637 . . . 20 . C6 . 20 . H6 parsed_2miy 1
27 . . . . . . . . . . . . . . . . 34.504 31.985 37.023 . . . 24 . C8 . 24 . H8 parsed_2miy 1
28 . . . . . . . . . . . . . . . . 27.852 25.333 30.371 . . . 25 . C8 . 25 . H8 parsed_2miy 1
29 . . . . . . . . . . . . . . . . -6.248 -8.767 -3.729 . . . 26 . C8 . 26 . H8 parsed_2miy 1
30 . . . . . . . . . . . . . . . . -5.732 -8.251 -3.213 . . . 27 . C6 . 27 . H6 parsed_2miy 1
31 . . . . . . . . . . . . . . . . 21.730 19.211 24.249 . . . 50 . C8 . 50 . H8 parsed_2miy 1
32 . . . . . . . . . . . . . . . . -3.981 -6.500 -1.462 . . . 53 . C8 . 53 . H8 parsed_2miy 1
33 . . . . . . . . . . . . . . . . -11.854 -14.373 -9.335 . . . 54 . C8 . 54 . H8 parsed_2miy 1
34 . . . . . . . . . . . . . . . . -11.047 -13.637 -8.457 . . . 4 . C1' . 4 . H1' parsed_2miy 1
35 . . . . . . . . . . . . . . . . -4.766 -7.356 -2.176 . . . 5 . C1' . 5 . H1' parsed_2miy 1
36 . . . . . . . . . . . . . . . . -11.319 -13.909 -8.729 . . . 8 . C1' . 8 . H1' parsed_2miy 1
37 . . . . . . . . . . . . . . . . -9.104 -11.694 -6.514 . . . 11 . C1' . 11 . H1' parsed_2miy 1
38 . . . . . . . . . . . . . . . . -12.380 -14.970 -9.790 . . . 12 . C1' . 12 . H1' parsed_2miy 1
39 . . . . . . . . . . . . . . . . -14.906 -17.496 -12.316 . . . 18 . C1' . 18 . H1' parsed_2miy 1
40 . . . . . . . . . . . . . . . . -11.111 -13.701 -8.521 . . . 19 . C1' . 19 . H1' parsed_2miy 1
41 . . . . . . . . . . . . . . . . -11.306 -13.896 -8.716 . . . 20 . C1' . 20 . H1' parsed_2miy 1
42 . . . . . . . . . . . . . . . . -16.434 -19.024 -13.844 . . . 21 . C1' . 21 . H1' parsed_2miy 1
43 . . . . . . . . . . . . . . . . -22.534 -25.124 -19.944 . . . 22 . C1' . 22 . H1' parsed_2miy 1
44 . . . . . . . . . . . . . . . . 4.312 1.722 6.902 . . . 25 . C1' . 25 . H1' parsed_2miy 1
45 . . . . . . . . . . . . . . . . 2.331 -0.259 4.921 . . . 26 . C1' . 26 . H1' parsed_2miy 1
46 . . . . . . . . . . . . . . . . -9.946 -12.536 -7.356 . . . 50 . C1' . 50 . H1' parsed_2miy 1
47 . . . . . . . . . . . . . . . . -17.548 -20.138 -14.958 . . . 51 . C1' . 51 . H1' parsed_2miy 1
48 . . . . . . . . . . . . . . . . -8.431 -11.021 -5.841 . . . 52 . C1' . 52 . H1' parsed_2miy 1
49 . . . . . . . . . . . . . . . . -8.379 -10.969 -5.789 . . . 53 . C1' . 53 . H1' parsed_2miy 1
50 . . . . . . . . . . . . . . . . -12.147 -14.737 -9.557 . . . 54 . C1' . 54 . H1' parsed_2miy 1
51 . . . . . . . . . . . . . . . . -11.901 -14.491 -9.311 . . . 55 . C1' . 55 . H1' parsed_2miy 1
52 . . . . . . . . . . . . . . . . -8.249 -10.839 -5.659 . . . 56 . C1' . 56 . H1' parsed_2miy 1
53 . . . . . . . . . . . . . . . . 8.159 5.569 10.749 . . . 57 . C1' . 57 . H1' parsed_2miy 1
54 . . . . . . . . . . . . . . . . 11.228 8.638 13.818 . . . 58 . C1' . 58 . H1' parsed_2miy 1
55 . . . . . . . . . . . . . . . . 17.838 15.319 20.357 . . . 1 . C5 . 1 . H5 parsed_2miy 1
56 . . . . . . . . . . . . . . . . -15.835 -18.354 -13.316 . . . 2 . C5 . 2 . H5 parsed_2miy 1
57 . . . . . . . . . . . . . . . . -11.463 -13.982 -8.944 . . . 3 . C5 . 3 . H5 parsed_2miy 1
58 . . . . . . . . . . . . . . . . 30.926 28.407 33.445 . . . 6 . C5 . 6 . H5 parsed_2miy 1
59 . . . . . . . . . . . . . . . . -4.951 -7.470 -2.432 . . . 8 . C5 . 8 . H5 parsed_2miy 1
60 . . . . . . . . . . . . . . . . -7.432 -9.951 -4.913 . . . 9 . C5 . 9 . H5 parsed_2miy 1
61 . . . . . . . . . . . . . . . . -15.003 -17.522 -12.484 . . . 10 . C5 . 10 . H5 parsed_2miy 1
62 . . . . . . . . . . . . . . . . -1.272 -3.791 1.247 . . . 13 . C5 . 13 . H5 parsed_2miy 1
63 . . . . . . . . . . . . . . . . 33.735 31.216 36.254 . . . 15 . C5 . 15 . H5 parsed_2miy 1
64 . . . . . . . . . . . . . . . . 20.143 17.624 22.662 . . . 16 . C5 . 16 . H5 parsed_2miy 1
65 . . . . . . . . . . . . . . . . -10.645 -13.164 -8.126 . . . 18 . C5 . 18 . H5 parsed_2miy 1
66 . . . . . . . . . . . . . . . . 8.579 6.060 11.098 . . . 19 . C5 . 19 . H5 parsed_2miy 1
67 . . . . . . . . . . . . . . . . 29.074 26.555 31.593 . . . 20 . C5 . 20 . H5 parsed_2miy 1
68 . . . . . . . . . . . . . . . . -10.758 -13.277 -8.239 . . . 22 . C5 . 22 . H5 parsed_2miy 1
69 . . . . . . . . . . . . . . . . -8.037 -10.556 -5.518 . . . 23 . C5 . 23 . H5 parsed_2miy 1
70 . . . . . . . . . . . . . . . . 6.299 3.780 8.818 . . . 27 . C5 . 27 . H5 parsed_2miy 1
71 . . . . . . . . . . . . . . . . -0.239 -2.758 2.280 . . . 29 . C5 . 29 . H5 parsed_2miy 1
72 . . . . . . . . . . . . . . . . -2.872 -5.391 -0.353 . . . 21 . C2 . 21 . H2 parsed_2miy 1
73 . . . . . . . . . . . . . . . . 26.416 23.897 28.935 . . . 24 . C2 . 24 . H2 parsed_2miy 1
74 . . . . . . . . . . . . . . . . 34.982 32.463 37.501 . . . 25 . C2 . 25 . H2 parsed_2miy 1
75 . . . . . . . . . . . . . . . . -7.924 -10.443 -5.405 . . . 28 . C2 . 28 . H2 parsed_2miy 1
76 . . . . . . . . . . . . . . . . -22.927 -25.446 -20.408 . . . 35 . C2 . 35 . H2 parsed_2miy 1
77 . . . . . . . . . . . . . . . . -0.567 -3.086 1.952 . . . 50 . C2 . 50 . H2 parsed_2miy 1
78 . . . . . . . . . . . . . . . . 29.376 26.857 31.895 . . . 52 . C2 . 52 . H2 parsed_2miy 1
79 . . . . . . . . . . . . . . . . -11.577 -14.096 -9.058 . . . 55 . C2 . 55 . H2 parsed_2miy 1
80 . . . . . . . . . . . . . . . . 12.169 9.650 14.688 . . . 57 . C2 . 57 . H2 parsed_2miy 1
81 . . . . . . . . . . . . . . . . 17.535 15.016 20.054 . . . 58 . C2 . 58 . H2 parsed_2miy 1
82 . . . . . . . . . . . . . . . . -0.281 -5.394 4.832 . . . 37 . N1 . 37 . H1 parsed_2miy 1
83 . . . . . . . . . . . . . . . . -19.634 -24.747 -14.521 . . . 39 . N1 . 39 . H1 parsed_2miy 1
84 . . . . . . . . . . . . . . . . -7.670 -12.783 -2.557 . . . 47 . N1 . 47 . H1 parsed_2miy 1
85 . . . . . . . . . . . . . . . . -13.177 -15.696 -10.658 . . . 35 . C8 . 35 . H8 parsed_2miy 1
86 . . . . . . . . . . . . . . . . 19.362 16.843 21.881 . . . 37 . C8 . 37 . H8 parsed_2miy 1
87 . . . . . . . . . . . . . . . . -12.446 -14.965 -9.927 . . . 38 . C6 . 38 . H6 parsed_2miy 1
88 . . . . . . . . . . . . . . . . -20.319 -22.838 -17.800 . . . 39 . C8 . 39 . H8 parsed_2miy 1
89 . . . . . . . . . . . . . . . . -9.120 -11.639 -6.601 . . . 43 . C8 . 43 . H8 parsed_2miy 1
90 . . . . . . . . . . . . . . . . -22.146 -24.665 -19.627 . . . 47 . C8 . 47 . H8 parsed_2miy 1
91 . . . . . . . . . . . . . . . . -12.924 -15.514 -10.334 . . . 35 . C1' . 35 . H1' parsed_2miy 1
92 . . . . . . . . . . . . . . . . 15.009 12.419 17.599 . . . 38 . C1' . 38 . H1' parsed_2miy 1
93 . . . . . . . . . . . . . . . . 18.364 15.774 20.954 . . . 39 . C1' . 39 . H1' parsed_2miy 1
94 . . . . . . . . . . . . . . . . 1.981 -0.609 4.571 . . . 40 . C1' . 40 . H1' parsed_2miy 1
95 . . . . . . . . . . . . . . . . 1.567 -1.023 4.157 . . . 46 . C1' . 46 . H1' parsed_2miy 1
96 . . . . . . . . . . . . . . . . -10.542 -13.132 -7.952 . . . 47 . C1' . 47 . H1' parsed_2miy 1
97 . . . . . . . . . . . . . . . . 6.268 3.678 8.858 . . . 49 . C1' . 49 . H1' parsed_2miy 1
98 . . . . . . . . . . . . . . . . 26.593 24.074 29.112 . . . 38 . C5 . 38 . H5 parsed_2miy 1
99 . . . . . . . . . . . . . . . . 14.965 12.446 17.484 . . . 46 . C5 . 46 . H5 parsed_2miy 1
100 . . . . . . . . . . . . . . . . -17.825 -20.344 -15.306 . . . 48 . C5 . 48 . H5 parsed_2miy 1
101 . . . . . . . . . . . . . . . . -8.730 -11.249 -6.211 . . . 49 . C5 . 49 . H5 parsed_2miy 1
102 . . . . . . . . . . . . . . . . -22.927 -25.446 -20.408 . . . 35 . C2 . 35 . H2 parsed_2miy 1
103 . . . . . . . . . . . . . . . . 15.230 12.711 17.749 . . . 45 . C5 . 45 . H5 parsed_2miy 1
stop_
save_
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