NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
614387 |
5jyv   |
30093 | cing | 2-parsed | STAR | dipolar coupling | 96 |
data_5jyv_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_5jyv
_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_5jyv 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_5jyv
_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 5jyv "Master copy" parsed_5jyv
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_5jyv
_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 5jyv.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_5jyv 1
1 5jyv.mr . . XPLOR/CNS 2 distance NOE ambi 737 parsed_5jyv 1
1 5jyv.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 376 parsed_5jyv 1
1 5jyv.mr . . XPLOR/CNS 4 distance NOE ambi 879 parsed_5jyv 1
1 5jyv.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 96 parsed_5jyv 1
1 5jyv.mr . . XPLOR/CNS 6 distance NOE ambi 0 parsed_5jyv 1
1 5jyv.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_5jyv 1
1 5jyv.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_5jyv 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_5
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_5jyv
_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 . . . . . . . . . . . . . . . . 4.2 3.2 5.2 . . . 3 . N . 3 . HN parsed_5jyv 1
2 . . . . . . . . . . . . . . . . -13.6 -14.6 -12.6 . . . 5 . N . 5 . HN parsed_5jyv 1
3 . . . . . . . . . . . . . . . . -10.2 -11.2 -9.2 . . . 7 . N . 7 . HN parsed_5jyv 1
4 . . . . . . . . . . . . . . . . 5.8 4.8 6.8 . . . 16 . N . 16 . HN parsed_5jyv 1
5 . . . . . . . . . . . . . . . . -4.2 -5.2 -3.2 . . . 27 . N . 27 . HN parsed_5jyv 1
6 . . . . . . . . . . . . . . . . 4.3 3.3 5.3 . . . 37 . N . 37 . HN parsed_5jyv 1
7 . . . . . . . . . . . . . . . . 8.5 7.5 9.5 . . . 38 . N . 38 . HN parsed_5jyv 1
8 . . . . . . . . . . . . . . . . 8.7 7.7 9.7 . . . 41 . N . 41 . HN parsed_5jyv 1
9 . . . . . . . . . . . . . . . . -4.7 -5.7 -3.7 . . . 50 . N . 50 . HN parsed_5jyv 1
10 . . . . . . . . . . . . . . . . 12.5 11.5 13.5 . . . 61 . N . 61 . HN parsed_5jyv 1
11 . . . . . . . . . . . . . . . . 17.6 16.6 18.6 . . . 62 . N . 62 . HN parsed_5jyv 1
12 . . . . . . . . . . . . . . . . -14.7 -15.7 -13.7 . . . 74 . N . 74 . HN parsed_5jyv 1
13 . . . . . . . . . . . . . . . . -18.4 -19.4 -17.4 . . . 75 . N . 75 . HN parsed_5jyv 1
14 . . . . . . . . . . . . . . . . 2.4 1.4 3.4 . . . 99 . N . 99 . HN parsed_5jyv 1
15 . . . . . . . . . . . . . . . . 6.1 5.1 7.1 . . . 100 . N . 100 . HN parsed_5jyv 1
16 . . . . . . . . . . . . . . . . 3.9 2.9 4.9 . . . 101 . N . 101 . HN parsed_5jyv 1
17 . . . . . . . . . . . . . . . . 12.4 11.4 13.4 . . . 103 . N . 103 . HN parsed_5jyv 1
18 . . . . . . . . . . . . . . . . -1.8 -2.8 -0.8 . . . 105 . N . 105 . HN parsed_5jyv 1
19 . . . . . . . . . . . . . . . . 8.0 7.0 9.0 . . . 106 . N . 106 . HN parsed_5jyv 1
20 . . . . . . . . . . . . . . . . 11.0 10.0 12.0 . . . 107 . N . 107 . HN parsed_5jyv 1
21 . . . . . . . . . . . . . . . . 1.0 0.8 1.2 . . . 2 . CA . 2 . C parsed_5jyv 1
22 . . . . . . . . . . . . . . . . -0.1 -0.3 0.1 . . . 7 . CA . 7 . C parsed_5jyv 1
23 . . . . . . . . . . . . . . . . -3.8 -4.0 -3.6 . . . 11 . CA . 11 . C parsed_5jyv 1
24 . . . . . . . . . . . . . . . . 2.6 2.4 2.8 . . . 15 . CA . 15 . C parsed_5jyv 1
25 . . . . . . . . . . . . . . . . 1.2 1.0 1.4 . . . 17 . CA . 17 . C parsed_5jyv 1
26 . . . . . . . . . . . . . . . . -3.6 -3.8 -3.4 . . . 18 . CA . 18 . C parsed_5jyv 1
27 . . . . . . . . . . . . . . . . -3.5 -3.7 -3.3 . . . 19 . CA . 19 . C parsed_5jyv 1
28 . . . . . . . . . . . . . . . . 0.7 0.5 0.9 . . . 36 . CA . 36 . C parsed_5jyv 1
29 . . . . . . . . . . . . . . . . -2.4 -2.6 -2.2 . . . 37 . CA . 37 . C parsed_5jyv 1
30 . . . . . . . . . . . . . . . . -4.5 -4.7 -4.3 . . . 40 . CA . 40 . C parsed_5jyv 1
31 . . . . . . . . . . . . . . . . 5.0 4.8 5.2 . . . 47 . CA . 47 . C parsed_5jyv 1
32 . . . . . . . . . . . . . . . . -0.6 -0.8 -0.4 . . . 49 . CA . 49 . C parsed_5jyv 1
33 . . . . . . . . . . . . . . . . -0.2 -0.4 0.0 . . . 57 . CA . 57 . C parsed_5jyv 1
34 . . . . . . . . . . . . . . . . 3.9 3.7 4.1 . . . 59 . CA . 59 . C parsed_5jyv 1
35 . . . . . . . . . . . . . . . . -0.7 -0.9 -0.5 . . . 60 . CA . 60 . C parsed_5jyv 1
36 . . . . . . . . . . . . . . . . 2.8 2.6 3.0 . . . 61 . CA . 61 . C parsed_5jyv 1
37 . . . . . . . . . . . . . . . . 4.0 3.8 4.2 . . . 62 . CA . 62 . C parsed_5jyv 1
38 . . . . . . . . . . . . . . . . 2.6 2.4 2.8 . . . 64 . CA . 64 . C parsed_5jyv 1
39 . . . . . . . . . . . . . . . . 1.3 1.1 1.5 . . . 77 . CA . 77 . C parsed_5jyv 1
40 . . . . . . . . . . . . . . . . 5.6 5.4 5.8 . . . 90 . CA . 90 . C parsed_5jyv 1
41 . . . . . . . . . . . . . . . . -3.1 -3.3 -2.9 . . . 91 . CA . 91 . C parsed_5jyv 1
42 . . . . . . . . . . . . . . . . 2.2 2.0 2.4 . . . 98 . CA . 98 . C parsed_5jyv 1
43 . . . . . . . . . . . . . . . . -3.1 -3.3 -2.9 . . . 99 . CA . 99 . C parsed_5jyv 1
44 . . . . . . . . . . . . . . . . 3.2 3.0 3.4 . . . 101 . CA . 101 . C parsed_5jyv 1
45 . . . . . . . . . . . . . . . . -2.2 -2.4 -2.0 . . . 102 . CA . 102 . C parsed_5jyv 1
46 . . . . . . . . . . . . . . . . 0.1 -0.1 0.3 . . . 104 . CA . 104 . C parsed_5jyv 1
47 . . . . . . . . . . . . . . . . 2.0 1.8 2.2 . . . 105 . CA . 105 . C parsed_5jyv 1
48 . . . . . . . . . . . . . . . . -1.0 -1.2 -0.8 . . . 106 . CA . 106 . C parsed_5jyv 1
49 . . . . . . . . . . . . . . . . -4.3 -4.5 -4.1 . . . 107 . CA . 107 . C parsed_5jyv 1
50 . . . . . . . . . . . . . . . . -1.2 -3.2 0.8 . . . 18 . HA . 18 . CA parsed_5jyv 1
51 . . . . . . . . . . . . . . . . 14.4 12.4 16.4 . . . 59 . HA . 59 . CA parsed_5jyv 1
52 . . . . . . . . . . . . . . . . -27.4 -29.4 -25.4 . . . 60 . HA . 60 . CA parsed_5jyv 1
53 . . . . . . . . . . . . . . . . -6.5 -8.5 -4.5 . . . 65 . HA . 65 . CA parsed_5jyv 1
54 . . . . . . . . . . . . . . . . -17.3 -19.3 -15.3 . . . 74 . HA . 74 . CA parsed_5jyv 1
55 . . . . . . . . . . . . . . . . 3.3 1.3 5.3 . . . 106 . HA . 106 . CA parsed_5jyv 1
56 . . . . . . . . . . . . . . . . 27.4 25.4 29.4 . . . 107 . HA . 107 . CA parsed_5jyv 1
57 . . . . . . . . . . . . . . . . -15.6 -16.6 -14.6 . . . 5 . N . 5 . HN parsed_5jyv 1
58 . . . . . . . . . . . . . . . . -16.1 -17.1 -15.1 . . . 6 . N . 6 . HN parsed_5jyv 1
59 . . . . . . . . . . . . . . . . -11.8 -12.8 -10.8 . . . 7 . N . 7 . HN parsed_5jyv 1
60 . . . . . . . . . . . . . . . . 8.7 7.7 9.7 . . . 11 . N . 11 . HN parsed_5jyv 1
61 . . . . . . . . . . . . . . . . 8.3 7.3 9.3 . . . 16 . N . 16 . HN parsed_5jyv 1
62 . . . . . . . . . . . . . . . . 9.3 8.3 10.3 . . . 21 . N . 21 . HN parsed_5jyv 1
63 . . . . . . . . . . . . . . . . 17.3 16.3 18.3 . . . 22 . N . 22 . HN parsed_5jyv 1
64 . . . . . . . . . . . . . . . . -8.1 -9.1 -7.1 . . . 27 . N . 27 . HN parsed_5jyv 1
65 . . . . . . . . . . . . . . . . -10.0 -11.0 -9.0 . . . 28 . N . 28 . HN parsed_5jyv 1
66 . . . . . . . . . . . . . . . . -17.6 -18.6 -16.6 . . . 29 . N . 29 . HN parsed_5jyv 1
67 . . . . . . . . . . . . . . . . 1.7 0.7 2.7 . . . 30 . NE1 . 30 . HE1 parsed_5jyv 1
68 . . . . . . . . . . . . . . . . -11.4 -12.4 -10.4 . . . 31 . N . 31 . HN parsed_5jyv 1
69 . . . . . . . . . . . . . . . . -0.3 -1.3 0.7 . . . 36 . N . 36 . HN parsed_5jyv 1
70 . . . . . . . . . . . . . . . . 6.3 5.3 7.3 . . . 37 . N . 37 . HN parsed_5jyv 1
71 . . . . . . . . . . . . . . . . 11.0 10.0 12.0 . . . 38 . N . 38 . HN parsed_5jyv 1
72 . . . . . . . . . . . . . . . . 0.7 -0.3 1.7 . . . 39 . N . 39 . HN parsed_5jyv 1
73 . . . . . . . . . . . . . . . . 10.8 9.8 11.8 . . . 41 . N . 41 . HN parsed_5jyv 1
74 . . . . . . . . . . . . . . . . -17.3 -18.3 -16.3 . . . 47 . N . 47 . HN parsed_5jyv 1
75 . . . . . . . . . . . . . . . . -12.9 -13.9 -11.9 . . . 48 . N . 48 . HN parsed_5jyv 1
76 . . . . . . . . . . . . . . . . -11.1 -12.1 -10.1 . . . 49 . N . 49 . HN parsed_5jyv 1
77 . . . . . . . . . . . . . . . . -7.1 -8.1 -6.1 . . . 50 . N . 50 . HN parsed_5jyv 1
78 . . . . . . . . . . . . . . . . 19.9 18.9 20.9 . . . 58 . N . 58 . HN parsed_5jyv 1
79 . . . . . . . . . . . . . . . . 16.4 15.4 17.4 . . . 61 . N . 61 . HN parsed_5jyv 1
80 . . . . . . . . . . . . . . . . 15.3 14.3 16.3 . . . 62 . N . 62 . HN parsed_5jyv 1
81 . . . . . . . . . . . . . . . . 18.7 17.7 19.7 . . . 63 . N . 63 . HN parsed_5jyv 1
82 . . . . . . . . . . . . . . . . 14.1 13.1 15.1 . . . 64 . N . 64 . HN parsed_5jyv 1
83 . . . . . . . . . . . . . . . . 16.8 15.8 17.8 . . . 65 . N . 65 . HN parsed_5jyv 1
84 . . . . . . . . . . . . . . . . -14.2 -15.2 -13.2 . . . 75 . N . 75 . HN parsed_5jyv 1
85 . . . . . . . . . . . . . . . . -14.0 -15.0 -13.0 . . . 76 . N . 76 . HN parsed_5jyv 1
86 . . . . . . . . . . . . . . . . -13.2 -14.2 -12.2 . . . 77 . N . 77 . HN parsed_5jyv 1
87 . . . . . . . . . . . . . . . . -7.7 -8.7 -6.7 . . . 78 . N . 78 . HN parsed_5jyv 1
88 . . . . . . . . . . . . . . . . -1.1 -2.1 -0.1 . . . 79 . N . 79 . HN parsed_5jyv 1
89 . . . . . . . . . . . . . . . . -4.7 -5.7 -3.7 . . . 90 . N . 90 . HN parsed_5jyv 1
90 . . . . . . . . . . . . . . . . -8.8 -9.8 -7.8 . . . 91 . N . 91 . HN parsed_5jyv 1
91 . . . . . . . . . . . . . . . . 13.2 12.2 14.2 . . . 99 . N . 99 . HN parsed_5jyv 1
92 . . . . . . . . . . . . . . . . 8.8 7.8 9.8 . . . 100 . N . 100 . HN parsed_5jyv 1
93 . . . . . . . . . . . . . . . . -0.5 -1.5 0.5 . . . 101 . N . 101 . HN parsed_5jyv 1
94 . . . . . . . . . . . . . . . . 0.4 -0.6 1.4 . . . 102 . N . 102 . HN parsed_5jyv 1
95 . . . . . . . . . . . . . . . . 4.1 3.1 5.1 . . . 106 . N . 106 . HN parsed_5jyv 1
96 . . . . . . . . . . . . . . . . 12.3 11.3 13.3 . . . 107 . N . 107 . HN parsed_5jyv 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 5: DN-HN_ThCikA_gel_complex_complete.tbl" 1 1 1 58 parsed_5jyv 1
2 "# Restraints file 6: DCA-C_ThCikA_gel_complex_complete.tbl" 142 1 142 58 parsed_5jyv 1
3 "# Restraints file 7: DH-CA_ThCikA_gel_complex_complete.tbl" 346 1 346 58 parsed_5jyv 1
4 "# Restraints file 8: DNH_gel_cika_2D_RDC.tbl" 396 1 396 44 parsed_5jyv 1
stop_
save_
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