NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
635527 |
6mk7   |
30523 | cing | 2-parsed | STAR | dipolar coupling | 82 |
data_6mk7_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_6mk7
_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_6mk7 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_6mk7
_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 6mk7 "Master copy" parsed_6mk7
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_6mk7
_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 6mk7.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_6mk7 1
1 6mk7.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 110 parsed_6mk7 1
1 6mk7.mr . . XPLOR/CNS 3 "dipolar coupling" "Not applicable" "Not applicable" 82 parsed_6mk7 1
1 6mk7.mr . . XPLOR/CNS 4 distance NOE simple 0 parsed_6mk7 1
1 6mk7.mr . . "MR format" 5 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_6mk7 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_3
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_6mk7
_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 . . . . . . . . . . . . . . . . -5.630 -6.630 -4.630 . . . 59 . N . 59 . HN parsed_6mk7 1
2 . . . . . . . . . . . . . . . . 13.490 12.490 14.490 . . . 60 . N . 60 . HN parsed_6mk7 1
3 . . . . . . . . . . . . . . . . 12.860 11.860 13.860 . . . 61 . N . 61 . HN parsed_6mk7 1
4 . . . . . . . . . . . . . . . . 20.980 19.980 21.980 . . . 62 . N . 62 . HN parsed_6mk7 1
5 . . . . . . . . . . . . . . . . 11.270 10.270 12.270 . . . 63 . N . 63 . HN parsed_6mk7 1
6 . . . . . . . . . . . . . . . . 2.390 1.390 3.390 . . . 64 . N . 64 . HN parsed_6mk7 1
7 . . . . . . . . . . . . . . . . -9.500 -10.500 -8.500 . . . 65 . N . 65 . HN parsed_6mk7 1
8 . . . . . . . . . . . . . . . . 19.820 18.820 20.820 . . . 66 . N . 66 . HN parsed_6mk7 1
9 . . . . . . . . . . . . . . . . 6.010 5.010 7.010 . . . 67 . N . 67 . HN parsed_6mk7 1
10 . . . . . . . . . . . . . . . . -8.670 -9.670 -7.670 . . . 68 . N . 68 . HN parsed_6mk7 1
11 . . . . . . . . . . . . . . . . -8.540 -9.540 -7.540 . . . 69 . N . 69 . HN parsed_6mk7 1
12 . . . . . . . . . . . . . . . . 4.920 3.920 5.920 . . . 70 . N . 70 . HN parsed_6mk7 1
13 . . . . . . . . . . . . . . . . 1.380 0.380 2.380 . . . 71 . N . 71 . HN parsed_6mk7 1
14 . . . . . . . . . . . . . . . . 4.570 3.570 5.570 . . . 73 . N . 73 . HN parsed_6mk7 1
15 . . . . . . . . . . . . . . . . -8.950 -9.950 -7.950 . . . 74 . N . 74 . HN parsed_6mk7 1
16 . . . . . . . . . . . . . . . . -8.540 -9.540 -7.540 . . . 75 . N . 75 . HN parsed_6mk7 1
17 . . . . . . . . . . . . . . . . 9.930 8.930 10.930 . . . 77 . N . 77 . HN parsed_6mk7 1
18 . . . . . . . . . . . . . . . . 2.500 1.500 3.500 . . . 78 . N . 78 . HN parsed_6mk7 1
19 . . . . . . . . . . . . . . . . -7.040 -8.040 -6.040 . . . 79 . N . 79 . HN parsed_6mk7 1
20 . . . . . . . . . . . . . . . . 10.180 9.180 11.180 . . . 80 . N . 80 . HN parsed_6mk7 1
21 . . . . . . . . . . . . . . . . 2.540 1.540 3.540 . . . 81 . N . 81 . HN parsed_6mk7 1
22 . . . . . . . . . . . . . . . . -1.450 -2.450 -0.450 . . . 82 . N . 82 . HN parsed_6mk7 1
23 . . . . . . . . . . . . . . . . -8.770 -9.770 -7.770 . . . 83 . N . 83 . HN parsed_6mk7 1
24 . . . . . . . . . . . . . . . . 12.450 11.450 13.450 . . . 84 . N . 84 . HN parsed_6mk7 1
25 . . . . . . . . . . . . . . . . -10.140 -11.140 -9.140 . . . 86 . N . 86 . HN parsed_6mk7 1
26 . . . . . . . . . . . . . . . . -9.740 -10.740 -8.740 . . . 87 . N . 87 . HN parsed_6mk7 1
27 . . . . . . . . . . . . . . . . -8.460 -9.460 -7.460 . . . 88 . N . 88 . HN parsed_6mk7 1
28 . . . . . . . . . . . . . . . . -8.200 -9.200 -7.200 . . . 89 . N . 89 . HN parsed_6mk7 1
29 . . . . . . . . . . . . . . . . -10.180 -11.180 -9.180 . . . 90 . N . 90 . HN parsed_6mk7 1
30 . . . . . . . . . . . . . . . . -11.090 -12.090 -10.090 . . . 92 . N . 92 . HN parsed_6mk7 1
31 . . . . . . . . . . . . . . . . -9.340 -10.340 -8.340 . . . 93 . N . 93 . HN parsed_6mk7 1
32 . . . . . . . . . . . . . . . . -10.630 -11.630 -9.630 . . . 94 . N . 94 . HN parsed_6mk7 1
33 . . . . . . . . . . . . . . . . -2.130 -3.130 -1.130 . . . 96 . N . 96 . HN parsed_6mk7 1
34 . . . . . . . . . . . . . . . . -9.460 -10.460 -8.460 . . . 97 . N . 97 . HN parsed_6mk7 1
35 . . . . . . . . . . . . . . . . 8.570 7.570 9.570 . . . 98 . N . 98 . HN parsed_6mk7 1
36 . . . . . . . . . . . . . . . . 8.150 7.150 9.150 . . . 99 . N . 99 . HN parsed_6mk7 1
37 . . . . . . . . . . . . . . . . -9.920 -10.920 -8.920 . . . 100 . N . 100 . HN parsed_6mk7 1
38 . . . . . . . . . . . . . . . . 3.220 2.220 4.220 . . . 101 . N . 101 . HN parsed_6mk7 1
39 . . . . . . . . . . . . . . . . 15.200 14.200 16.200 . . . 103 . N . 103 . HN parsed_6mk7 1
40 . . . . . . . . . . . . . . . . 9.880 8.880 10.880 . . . 104 . N . 104 . HN parsed_6mk7 1
41 . . . . . . . . . . . . . . . . 16.320 15.320 17.320 . . . 105 . N . 105 . HN parsed_6mk7 1
42 . . . . . . . . . . . . . . . . 11.610 10.610 12.610 . . . 106 . N . 106 . HN parsed_6mk7 1
43 . . . . . . . . . . . . . . . . 19.220 18.220 20.220 . . . 107 . N . 107 . HN parsed_6mk7 1
44 . . . . . . . . . . . . . . . . -9.680 -10.680 -8.680 . . . 108 . N . 108 . HN parsed_6mk7 1
45 . . . . . . . . . . . . . . . . -7.990 -8.990 -6.990 . . . 109 . N . 109 . HN parsed_6mk7 1
46 . . . . . . . . . . . . . . . . -8.170 -9.170 -7.170 . . . 110 . N . 110 . HN parsed_6mk7 1
47 . . . . . . . . . . . . . . . . -9.510 -10.510 -8.510 . . . 111 . N . 111 . HN parsed_6mk7 1
48 . . . . . . . . . . . . . . . . -8.090 -9.090 -7.090 . . . 113 . N . 113 . HN parsed_6mk7 1
49 . . . . . . . . . . . . . . . . -8.970 -9.970 -7.970 . . . 114 . N . 114 . HN parsed_6mk7 1
50 . . . . . . . . . . . . . . . . -9.760 -10.760 -8.760 . . . 115 . N . 115 . HN parsed_6mk7 1
51 . . . . . . . . . . . . . . . . -4.230 -5.230 -3.230 . . . 116 . N . 116 . HN parsed_6mk7 1
52 . . . . . . . . . . . . . . . . -8.250 -9.250 -7.250 . . . 117 . N . 117 . HN parsed_6mk7 1
53 . . . . . . . . . . . . . . . . -7.350 -8.350 -6.350 . . . 118 . N . 118 . HN parsed_6mk7 1
54 . . . . . . . . . . . . . . . . 7.050 6.050 8.050 . . . 123 . N . 123 . HN parsed_6mk7 1
55 . . . . . . . . . . . . . . . . -9.670 -10.670 -8.670 . . . 134 . N . 134 . HN parsed_6mk7 1
56 . . . . . . . . . . . . . . . . -3.620 -4.620 -2.620 . . . 135 . N . 135 . HN parsed_6mk7 1
57 . . . . . . . . . . . . . . . . 12.340 11.340 13.340 . . . 136 . N . 136 . HN parsed_6mk7 1
58 . . . . . . . . . . . . . . . . 18.110 17.110 19.110 . . . 137 . N . 137 . HN parsed_6mk7 1
59 . . . . . . . . . . . . . . . . 15.510 14.510 16.510 . . . 139 . N . 139 . HN parsed_6mk7 1
60 . . . . . . . . . . . . . . . . 0.740 -0.260 1.740 . . . 140 . N . 140 . HN parsed_6mk7 1
61 . . . . . . . . . . . . . . . . -3.670 -4.670 -2.670 . . . 141 . N . 141 . HN parsed_6mk7 1
62 . . . . . . . . . . . . . . . . -2.150 -3.150 -1.150 . . . 142 . N . 142 . HN parsed_6mk7 1
63 . . . . . . . . . . . . . . . . 3.530 2.530 4.530 . . . 143 . N . 143 . HN parsed_6mk7 1
64 . . . . . . . . . . . . . . . . 7.730 6.730 8.730 . . . 145 . N . 145 . HN parsed_6mk7 1
65 . . . . . . . . . . . . . . . . 12.250 11.250 13.250 . . . 146 . N . 146 . HN parsed_6mk7 1
66 . . . . . . . . . . . . . . . . -8.810 -9.810 -7.810 . . . 147 . N . 147 . HN parsed_6mk7 1
67 . . . . . . . . . . . . . . . . -10.630 -11.630 -9.630 . . . 148 . N . 148 . HN parsed_6mk7 1
68 . . . . . . . . . . . . . . . . 2.360 1.360 3.360 . . . 149 . N . 149 . HN parsed_6mk7 1
69 . . . . . . . . . . . . . . . . -6.330 -7.330 -5.330 . . . 150 . N . 150 . HN parsed_6mk7 1
70 . . . . . . . . . . . . . . . . -11.480 -12.480 -10.480 . . . 151 . N . 151 . HN parsed_6mk7 1
71 . . . . . . . . . . . . . . . . -7.090 -8.090 -6.090 . . . 152 . N . 152 . HN parsed_6mk7 1
72 . . . . . . . . . . . . . . . . -1.910 -2.910 -0.910 . . . 153 . N . 153 . HN parsed_6mk7 1
73 . . . . . . . . . . . . . . . . -10.590 -11.590 -9.590 . . . 154 . N . 154 . HN parsed_6mk7 1
74 . . . . . . . . . . . . . . . . 1.640 0.640 2.640 . . . 156 . N . 156 . HN parsed_6mk7 1
75 . . . . . . . . . . . . . . . . -9.760 -10.760 -8.760 . . . 157 . N . 157 . HN parsed_6mk7 1
76 . . . . . . . . . . . . . . . . -4.940 -5.940 -3.940 . . . 158 . N . 158 . HN parsed_6mk7 1
77 . . . . . . . . . . . . . . . . 18.660 17.660 19.660 . . . 159 . N . 159 . HN parsed_6mk7 1
78 . . . . . . . . . . . . . . . . -6.970 -7.970 -5.970 . . . 160 . N . 160 . HN parsed_6mk7 1
79 . . . . . . . . . . . . . . . . 14.850 13.850 15.850 . . . 161 . N . 161 . HN parsed_6mk7 1
80 . . . . . . . . . . . . . . . . 18.310 17.310 19.310 . . . 162 . N . 162 . HN parsed_6mk7 1
81 . . . . . . . . . . . . . . . . 18.220 17.220 19.220 . . . 163 . N . 163 . HN parsed_6mk7 1
82 . . . . . . . . . . . . . . . . 15.290 14.290 16.290 . . . 164 . N . 164 . HN parsed_6mk7 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 2: ECL1_rdc_try5.tbl" 1 1 1 38 parsed_6mk7 1
stop_
save_
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