NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
533395 |
2km8   |
16425 | cing | 2-parsed | STAR | dipolar coupling | 55 |
data_2km8_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2km8
_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_2km8 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2km8
_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 2km8 "Master copy" parsed_2km8
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2km8
_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 2km8.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2km8 1
1 2km8.mr . . XPLOR/CNS 2 distance NOE simple 4662 parsed_2km8 1
1 2km8.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 132 parsed_2km8 1
1 2km8.mr . . XPLOR/CNS 4 "dihedral angle" "Not applicable" "Not applicable" 203 parsed_2km8 1
1 2km8.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 96 parsed_2km8 1
1 2km8.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 55 parsed_2km8 1
1 2km8.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2km8 1
1 2km8.mr . . XPLOR/CNS 8 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2km8 1
1 2km8.mr . . XPLOR/CNS 9 distance NOE simple 0 parsed_2km8 1
1 2km8.mr . . "MR format" 10 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2km8 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_6
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2km8
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 6
_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 . . . . . . . . . . . . . . . . 7.06 . . . . . 25 . HN . 25 . N parsed_2km8 1
2 . . . . . . . . . . . . . . . . 7.74 . . . . . 26 . HN . 26 . N parsed_2km8 1
3 . . . . . . . . . . . . . . . . 5.53 . . . . . 27 . HN . 27 . N parsed_2km8 1
4 . . . . . . . . . . . . . . . . 11.67 . . . . . 28 . HN . 28 . N parsed_2km8 1
5 . . . . . . . . . . . . . . . . -4.99 . . . . . 36 . HN . 36 . N parsed_2km8 1
6 . . . . . . . . . . . . . . . . -15.77 . . . . . 37 . HN . 37 . N parsed_2km8 1
7 . . . . . . . . . . . . . . . . 11.08 . . . . . 38 . HN . 38 . N parsed_2km8 1
8 . . . . . . . . . . . . . . . . 8.53 . . . . . 39 . HN . 39 . N parsed_2km8 1
9 . . . . . . . . . . . . . . . . 1.98 . . . . . 40 . HN . 40 . N parsed_2km8 1
10 . . . . . . . . . . . . . . . . -1.68 . . . . . 41 . HN . 41 . N parsed_2km8 1
11 . . . . . . . . . . . . . . . . 5.97 . . . . . 42 . HN . 42 . N parsed_2km8 1
12 . . . . . . . . . . . . . . . . 9.39 . . . . . 43 . HN . 43 . N parsed_2km8 1
13 . . . . . . . . . . . . . . . . -2.58 . . . . . 44 . HN . 44 . N parsed_2km8 1
14 . . . . . . . . . . . . . . . . 5.67 . . . . . 45 . HN . 45 . N parsed_2km8 1
15 . . . . . . . . . . . . . . . . 6.18 . . . . . 46 . HN . 46 . N parsed_2km8 1
16 . . . . . . . . . . . . . . . . -2.33 . . . . . 47 . HN . 47 . N parsed_2km8 1
17 . . . . . . . . . . . . . . . . -8.61 . . . . . 48 . HN . 48 . N parsed_2km8 1
18 . . . . . . . . . . . . . . . . 7.04 . . . . . 49 . HN . 49 . N parsed_2km8 1
19 . . . . . . . . . . . . . . . . 3 . . . . . 50 . HN . 50 . N parsed_2km8 1
20 . . . . . . . . . . . . . . . . 11.56 . . . . . 52 . HN . 52 . N parsed_2km8 1
21 . . . . . . . . . . . . . . . . -4.66 . . . . . 53 . HN . 53 . N parsed_2km8 1
22 . . . . . . . . . . . . . . . . -0.61 . . . . . 50 . HN . 50 . N parsed_2km8 1
23 . . . . . . . . . . . . . . . . -5.31 . . . . . 55 . HN . 55 . N parsed_2km8 1
24 . . . . . . . . . . . . . . . . -1.71 . . . . . 56 . HN . 56 . N parsed_2km8 1
25 . . . . . . . . . . . . . . . . -6.3 . . . . . 57 . HN . 57 . N parsed_2km8 1
26 . . . . . . . . . . . . . . . . -5.37 . . . . . 58 . HN . 58 . N parsed_2km8 1
27 . . . . . . . . . . . . . . . . -3.64 . . . . . 59 . HN . 59 . N parsed_2km8 1
28 . . . . . . . . . . . . . . . . -8.72 . . . . . 68 . HN . 68 . N parsed_2km8 1
29 . . . . . . . . . . . . . . . . 0.58 . . . . . 70 . HN . 70 . N parsed_2km8 1
30 . . . . . . . . . . . . . . . . 9.55 . . . . . 71 . HN . 71 . N parsed_2km8 1
31 . . . . . . . . . . . . . . . . -6.25 . . . . . 72 . HN . 72 . N parsed_2km8 1
32 . . . . . . . . . . . . . . . . 2.2 . . . . . 73 . HN . 73 . N parsed_2km8 1
33 . . . . . . . . . . . . . . . . 0.91 . . . . . 74 . HN . 74 . N parsed_2km8 1
34 . . . . . . . . . . . . . . . . -9.6 . . . . . 75 . HN . 75 . N parsed_2km8 1
35 . . . . . . . . . . . . . . . . 2.65 . . . . . 76 . HN . 76 . N parsed_2km8 1
36 . . . . . . . . . . . . . . . . -10.6 . . . . . 77 . HN . 77 . N parsed_2km8 1
37 . . . . . . . . . . . . . . . . -23.27 . . . . . 78 . HN . 78 . N parsed_2km8 1
38 . . . . . . . . . . . . . . . . -13.35 . . . . . 79 . HN . 79 . N parsed_2km8 1
39 . . . . . . . . . . . . . . . . -7.72 . . . . . 80 . HN . 80 . N parsed_2km8 1
40 . . . . . . . . . . . . . . . . -17.19 . . . . . 81 . HN . 81 . N parsed_2km8 1
41 . . . . . . . . . . . . . . . . -15.38 . . . . . 82 . HN . 82 . N parsed_2km8 1
42 . . . . . . . . . . . . . . . . 0.81 . . . . . 83 . HN . 83 . N parsed_2km8 1
43 . . . . . . . . . . . . . . . . -10.85 . . . . . 84 . HN . 84 . N parsed_2km8 1
44 . . . . . . . . . . . . . . . . -18.86 . . . . . 85 . HN . 85 . N parsed_2km8 1
45 . . . . . . . . . . . . . . . . -13.3 . . . . . 86 . HN . 86 . N parsed_2km8 1
46 . . . . . . . . . . . . . . . . -2.22 . . . . . 87 . HN . 87 . N parsed_2km8 1
47 . . . . . . . . . . . . . . . . -14.95 . . . . . 88 . HN . 88 . N parsed_2km8 1
48 . . . . . . . . . . . . . . . . 7.06 . . . . . 89 . HN . 89 . N parsed_2km8 1
49 . . . . . . . . . . . . . . . . 6.43 . . . . . 90 . HN . 90 . N parsed_2km8 1
50 . . . . . . . . . . . . . . . . 1.61 . . . . . 91 . HN . 91 . N parsed_2km8 1
51 . . . . . . . . . . . . . . . . 5.09 . . . . . 96 . HN . 96 . N parsed_2km8 1
52 . . . . . . . . . . . . . . . . 7.55 . . . . . 97 . HN . 97 . N parsed_2km8 1
53 . . . . . . . . . . . . . . . . -3.92 . . . . . 99 . HN . 99 . N parsed_2km8 1
54 . . . . . . . . . . . . . . . . 5.19 . . . . . 100 . HN . 100 . N parsed_2km8 1
55 . . . . . . . . . . . . . . . . -16.14 . . . . . 102 . HN . 102 . N parsed_2km8 1
stop_
loop_
_RDC_constraint_comment_org.ID
_RDC_constraint_comment_org.Comment_text
_RDC_constraint_comment_org.Comment_begin_line
_RDC_constraint_comment_org.Comment_begin_column
_RDC_constraint_comment_org.Comment_end_line
_RDC_constraint_comment_org.Comment_end_column
_RDC_constraint_comment_org.Entry_ID
_RDC_constraint_comment_org.RDC_constraint_list_ID
1 "! S25N-HN" 6 48 6 58 parsed_2km8 1
2 "! R26N-HN" 12 45 12 56 parsed_2km8 1
3 "! V27N-HN" 18 48 18 59 parsed_2km8 1
4 "! V28N-HN" 24 49 24 60 parsed_2km8 1
5 "! D36N-HN" 30 49 30 60 parsed_2km8 1
6 "! Q37N-HN" 36 50 36 61 parsed_2km8 1
7 "! T38N-HN" 42 49 42 60 parsed_2km8 1
8 "! E39N-HN" 48 48 48 59 parsed_2km8 1
9 "! E40N-HN" 54 48 54 59 parsed_2km8 1
10 "! Q41N-HN" 60 49 60 60 parsed_2km8 1
11 "! I42N-HN" 66 48 66 58 parsed_2km8 1
12 "! L43N-HN" 72 48 72 58 parsed_2km8 1
13 "! D44N-HN" 78 49 78 59 parsed_2km8 1
14 "! L45N-HN" 84 48 84 58 parsed_2km8 1
15 "! C46N-HN" 90 48 90 59 parsed_2km8 1
16 "! S47N-HN" 96 49 96 60 parsed_2km8 1
17 "! N48N-HN" 102 49 102 60 parsed_2km8 1
18 "! V49N-HN" 108 48 108 59 parsed_2km8 1
19 "! G50N-HN" 114 45 114 56 parsed_2km8 1
20 "! V52N-HN" 120 49 120 60 parsed_2km8 1
21 "! I53N-HN" 126 49 126 60 parsed_2km8 1
22 "! N54N-HN" 132 49 132 60 parsed_2km8 1
23 "! L55N-HN" 138 49 138 60 parsed_2km8 1
24 "! K56N-HN" 144 49 144 60 parsed_2km8 1
25 "! M57N-HN" 150 48 150 59 parsed_2km8 1
26 "! M58N-HN" 156 49 156 60 parsed_2km8 1
27 "! F59N-HN" 162 49 162 60 parsed_2km8 1
28 "! G68N-HN" 168 49 168 60 parsed_2km8 1
29 "! A70N-HN" 174 48 174 59 parsed_2km8 1
30 "! F71N-HN" 180 48 180 59 parsed_2km8 1
31 "! I72N-HN" 186 49 186 60 parsed_2km8 1
32 "! E73N-HN" 192 47 192 58 parsed_2km8 1
33 "! F74N-HN" 198 48 198 59 parsed_2km8 1
34 "! R75N-HN" 204 48 204 59 parsed_2km8 1
35 "! D76N-HN" 210 48 210 59 parsed_2km8 1
36 "! L77N-HN" 216 49 216 60 parsed_2km8 1
37 "! E78N-HN" 222 50 222 61 parsed_2km8 1
38 "! S79N-HN" 228 50 228 61 parsed_2km8 1
39 "! S80N-HN" 234 49 234 60 parsed_2km8 1
40 "! A81N-HN" 240 50 240 61 parsed_2km8 1
41 "! S82N-HN" 246 50 246 61 parsed_2km8 1
42 "! A83N-HN" 252 48 252 59 parsed_2km8 1
43 "! V84N-HN" 258 50 258 61 parsed_2km8 1
44 "! R85N-HN" 264 50 264 61 parsed_2km8 1
45 "! N86N-HN" 270 49 270 60 parsed_2km8 1
46 "! L87N-HN" 276 49 276 60 parsed_2km8 1
47 "! N88N-HN" 282 50 282 61 parsed_2km8 1
48 "! G89N-HN" 288 48 288 59 parsed_2km8 1
49 "! Y90N-HN" 294 48 294 59 parsed_2km8 1
50 "! Q91N-HN" 300 48 300 59 parsed_2km8 1
51 "! F96N-HN" 306 48 306 59 parsed_2km8 1
52 "! L97N-HN" 312 48 312 59 parsed_2km8 1
53 "! C99N-HN" 318 49 318 60 parsed_2km8 1
54 "! Y101N-HN" 324 48 324 60 parsed_2km8 1
55 "! S102N-HN" 330 50 330 62 parsed_2km8 1
stop_
save_
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