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 |
|
|
617309 |
5ghd   |
36008 | cing | 2-parsed | STAR | dipolar coupling | 53 |
data_5ghd_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5ghd
_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_5ghd 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5ghd
_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 5ghd "Master copy" parsed_5ghd
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5ghd
_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 5ghd.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5ghd 1
1 5ghd.mr . . XPLOR/CNS 2 "dihedral angle" "Not applicable" "Not applicable" 134 parsed_5ghd 1
1 5ghd.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 58 parsed_5ghd 1
1 5ghd.mr . . XPLOR/CNS 4 distance NOE simple 2137 parsed_5ghd 1
1 5ghd.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 53 parsed_5ghd 1
1 5ghd.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5ghd 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_5ghd
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 5
_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 . . . . . . . . . . . . . . . . -1.340 . . . . . 2 . N . 2 . HN parsed_5ghd 1
2 . . . . . . . . . . . . . . . . -0.190 . . . . . 4 . N . 4 . HN parsed_5ghd 1
3 . . . . . . . . . . . . . . . . -1.700 . . . . . 6 . N . 6 . HN parsed_5ghd 1
4 . . . . . . . . . . . . . . . . -2.620 . . . . . 9 . N . 9 . HN parsed_5ghd 1
5 . . . . . . . . . . . . . . . . -2.250 . . . . . 10 . N . 10 . HN parsed_5ghd 1
6 . . . . . . . . . . . . . . . . -4.500 . . . . . 13 . N . 13 . HN parsed_5ghd 1
7 . . . . . . . . . . . . . . . . -0.850 . . . . . 14 . N . 14 . HN parsed_5ghd 1
8 . . . . . . . . . . . . . . . . -0.180 . . . . . 15 . N . 15 . HN parsed_5ghd 1
9 . . . . . . . . . . . . . . . . 0.360 . . . . . 19 . N . 19 . HN parsed_5ghd 1
10 . . . . . . . . . . . . . . . . -3.040 . . . . . 25 . N . 25 . HN parsed_5ghd 1
11 . . . . . . . . . . . . . . . . -2.670 . . . . . 26 . N . 26 . HN parsed_5ghd 1
12 . . . . . . . . . . . . . . . . -1.880 . . . . . 27 . N . 27 . HN parsed_5ghd 1
13 . . . . . . . . . . . . . . . . -3.100 . . . . . 28 . N . 28 . HN parsed_5ghd 1
14 . . . . . . . . . . . . . . . . -5.530 . . . . . 30 . N . 30 . HN parsed_5ghd 1
15 . . . . . . . . . . . . . . . . 4.200 . . . . . 32 . N . 32 . HN parsed_5ghd 1
16 . . . . . . . . . . . . . . . . -0.060 . . . . . 33 . N . 33 . HN parsed_5ghd 1
17 . . . . . . . . . . . . . . . . -1.580 . . . . . 34 . N . 34 . HN parsed_5ghd 1
18 . . . . . . . . . . . . . . . . -2.730 . . . . . 37 . N . 37 . HN parsed_5ghd 1
19 . . . . . . . . . . . . . . . . 0.000 . . . . . 40 . N . 40 . HN parsed_5ghd 1
20 . . . . . . . . . . . . . . . . 1.830 . . . . . 41 . N . 41 . HN parsed_5ghd 1
21 . . . . . . . . . . . . . . . . -1.090 . . . . . 44 . N . 44 . HN parsed_5ghd 1
22 . . . . . . . . . . . . . . . . 0.800 . . . . . 47 . N . 47 . HN parsed_5ghd 1
23 . . . . . . . . . . . . . . . . 1.890 . . . . . 48 . N . 48 . HN parsed_5ghd 1
24 . . . . . . . . . . . . . . . . 3.590 . . . . . 49 . N . 49 . HN parsed_5ghd 1
25 . . . . . . . . . . . . . . . . 2.560 . . . . . 52 . N . 52 . HN parsed_5ghd 1
26 . . . . . . . . . . . . . . . . 5.710 . . . . . 54 . N . 54 . HN parsed_5ghd 1
27 . . . . . . . . . . . . . . . . 10.400 . . . . . 56 . N . 56 . HN parsed_5ghd 1
28 . . . . . . . . . . . . . . . . -9.360 . . . . . 59 . N . 59 . HN parsed_5ghd 1
29 . . . . . . . . . . . . . . . . -2.740 . . . . . 60 . N . 60 . HN parsed_5ghd 1
30 . . . . . . . . . . . . . . . . -0.190 . . . . . 61 . N . 61 . HN parsed_5ghd 1
31 . . . . . . . . . . . . . . . . -8.390 . . . . . 62 . N . 62 . HN parsed_5ghd 1
32 . . . . . . . . . . . . . . . . -7.670 . . . . . 63 . N . 63 . HN parsed_5ghd 1
33 . . . . . . . . . . . . . . . . -9.860 . . . . . 64 . N . 64 . HN parsed_5ghd 1
34 . . . . . . . . . . . . . . . . -4.320 . . . . . 65 . N . 65 . HN parsed_5ghd 1
35 . . . . . . . . . . . . . . . . -5.530 . . . . . 66 . N . 66 . HN parsed_5ghd 1
36 . . . . . . . . . . . . . . . . -5.230 . . . . . 67 . N . 67 . HN parsed_5ghd 1
37 . . . . . . . . . . . . . . . . -1.580 . . . . . 68 . N . 68 . HN parsed_5ghd 1
38 . . . . . . . . . . . . . . . . -0.250 . . . . . 70 . N . 70 . HN parsed_5ghd 1
39 . . . . . . . . . . . . . . . . 1.520 . . . . . 71 . N . 71 . HN parsed_5ghd 1
40 . . . . . . . . . . . . . . . . 2.010 . . . . . 74 . N . 74 . HN parsed_5ghd 1
41 . . . . . . . . . . . . . . . . -0.790 . . . . . 76 . N . 76 . HN parsed_5ghd 1
42 . . . . . . . . . . . . . . . . -7.300 . . . . . 81 . N . 81 . HN parsed_5ghd 1
43 . . . . . . . . . . . . . . . . 7.480 . . . . . 83 . N . 83 . HN parsed_5ghd 1
44 . . . . . . . . . . . . . . . . -10.460 . . . . . 85 . N . 85 . HN parsed_5ghd 1
45 . . . . . . . . . . . . . . . . -0.920 . . . . . 86 . N . 86 . HN parsed_5ghd 1
46 . . . . . . . . . . . . . . . . -2.370 . . . . . 87 . N . 87 . HN parsed_5ghd 1
47 . . . . . . . . . . . . . . . . -1.880 . . . . . 88 . N . 88 . HN parsed_5ghd 1
48 . . . . . . . . . . . . . . . . -2.070 . . . . . 89 . N . 89 . HN parsed_5ghd 1
49 . . . . . . . . . . . . . . . . -7.670 . . . . . 90 . N . 90 . HN parsed_5ghd 1
50 . . . . . . . . . . . . . . . . -3.040 . . . . . 93 . N . 93 . HN parsed_5ghd 1
51 . . . . . . . . . . . . . . . . 1.100 . . . . . 94 . N . 94 . HN parsed_5ghd 1
52 . . . . . . . . . . . . . . . . -2.190 . . . . . 95 . N . 95 . HN parsed_5ghd 1
53 . . . . . . . . . . . . . . . . -1.280 . . . . . 96 . N . 96 . HN parsed_5ghd 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
;
RDC file produced by PDBStat
Version: 5.10-exp lun sep 9 13:43:44 UTC 2013
;
2 1 5 2 parsed_5ghd 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 4: K39_rdc1.tbl" 1 1 1 33 parsed_5ghd 1
stop_
save_
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