NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
527733 |
2lm4   |
18098 | cing | 2-parsed | STAR | dipolar coupling | 60 |
data_2lm4_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lm4
_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_2lm4 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lm4
_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 2lm4 "Master copy" parsed_2lm4
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lm4
_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 2lm4.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lm4 1
1 2lm4.mr . . XPLOR/CNS 2 distance NOE simple 1723 parsed_2lm4 1
1 2lm4.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 118 parsed_2lm4 1
1 2lm4.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 60 parsed_2lm4 1
1 2lm4.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2lm4 1
1 2lm4.mr . . "MR format" 6 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lm4 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2lm4
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 4
_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 . . . . . . . . . . . . . . . . 3.2300 . . . . . 21 . N . 21 . HN parsed_2lm4 1
2 . . . . . . . . . . . . . . . . 4.2900 . . . . . 22 . N . 22 . HN parsed_2lm4 1
3 . . . . . . . . . . . . . . . . 2.2600 . . . . . 23 . N . 23 . HN parsed_2lm4 1
4 . . . . . . . . . . . . . . . . 1.1400 . . . . . 24 . N . 24 . HN parsed_2lm4 1
5 . . . . . . . . . . . . . . . . 3.8100 . . . . . 25 . N . 25 . HN parsed_2lm4 1
6 . . . . . . . . . . . . . . . . 3.4500 . . . . . 26 . N . 26 . HN parsed_2lm4 1
7 . . . . . . . . . . . . . . . . 2.1600 . . . . . 28 . N . 28 . HN parsed_2lm4 1
8 . . . . . . . . . . . . . . . . 0.2800 . . . . . 30 . N . 30 . HN parsed_2lm4 1
9 . . . . . . . . . . . . . . . . 1.4200 . . . . . 34 . N . 34 . HN parsed_2lm4 1
10 . . . . . . . . . . . . . . . . 5.2000 . . . . . 36 . N . 36 . HN parsed_2lm4 1
11 . . . . . . . . . . . . . . . . 3.0200 . . . . . 37 . N . 37 . HN parsed_2lm4 1
12 . . . . . . . . . . . . . . . . 4.2000 . . . . . 38 . N . 38 . HN parsed_2lm4 1
13 . . . . . . . . . . . . . . . . 4.6200 . . . . . 39 . N . 39 . HN parsed_2lm4 1
14 . . . . . . . . . . . . . . . . 1.4000 . . . . . 40 . N . 40 . HN parsed_2lm4 1
15 . . . . . . . . . . . . . . . . 3.4900 . . . . . 41 . N . 41 . HN parsed_2lm4 1
16 . . . . . . . . . . . . . . . . 5.6100 . . . . . 43 . N . 43 . HN parsed_2lm4 1
17 . . . . . . . . . . . . . . . . 1.1300 . . . . . 44 . N . 44 . HN parsed_2lm4 1
18 . . . . . . . . . . . . . . . . 2.2000 . . . . . 45 . N . 45 . HN parsed_2lm4 1
19 . . . . . . . . . . . . . . . . 2.2100 . . . . . 46 . N . 46 . HN parsed_2lm4 1
20 . . . . . . . . . . . . . . . . 3.4800 . . . . . 47 . N . 47 . HN parsed_2lm4 1
21 . . . . . . . . . . . . . . . . 0.6900 . . . . . 48 . N . 48 . HN parsed_2lm4 1
22 . . . . . . . . . . . . . . . . 4.0700 . . . . . 49 . N . 49 . HN parsed_2lm4 1
23 . . . . . . . . . . . . . . . . 5.0800 . . . . . 50 . N . 50 . HN parsed_2lm4 1
24 . . . . . . . . . . . . . . . . 3.0400 . . . . . 51 . N . 51 . HN parsed_2lm4 1
25 . . . . . . . . . . . . . . . . 1.9100 . . . . . 52 . N . 52 . HN parsed_2lm4 1
26 . . . . . . . . . . . . . . . . 3.7800 . . . . . 53 . N . 53 . HN parsed_2lm4 1
27 . . . . . . . . . . . . . . . . -5.1100 . . . . . 54 . N . 54 . HN parsed_2lm4 1
28 . . . . . . . . . . . . . . . . 2.7800 . . . . . 55 . N . 55 . HN parsed_2lm4 1
29 . . . . . . . . . . . . . . . . 3.6000 . . . . . 56 . N . 56 . HN parsed_2lm4 1
30 . . . . . . . . . . . . . . . . 1.2600 . . . . . 57 . N . 57 . HN parsed_2lm4 1
31 . . . . . . . . . . . . . . . . 2.8900 . . . . . 58 . N . 58 . HN parsed_2lm4 1
32 . . . . . . . . . . . . . . . . 2.1700 . . . . . 60 . N . 60 . HN parsed_2lm4 1
33 . . . . . . . . . . . . . . . . 1.9600 . . . . . 61 . N . 61 . HN parsed_2lm4 1
34 . . . . . . . . . . . . . . . . 4.1700 . . . . . 62 . N . 62 . HN parsed_2lm4 1
35 . . . . . . . . . . . . . . . . 4.3300 . . . . . 63 . N . 63 . HN parsed_2lm4 1
36 . . . . . . . . . . . . . . . . 2.6400 . . . . . 64 . N . 64 . HN parsed_2lm4 1
37 . . . . . . . . . . . . . . . . 2.1600 . . . . . 65 . N . 65 . HN parsed_2lm4 1
38 . . . . . . . . . . . . . . . . 3.8900 . . . . . 66 . N . 66 . HN parsed_2lm4 1
39 . . . . . . . . . . . . . . . . 2.0000 . . . . . 67 . N . 67 . HN parsed_2lm4 1
40 . . . . . . . . . . . . . . . . -2.6000 . . . . . 68 . N . 68 . HN parsed_2lm4 1
41 . . . . . . . . . . . . . . . . -1.2400 . . . . . 69 . N . 69 . HN parsed_2lm4 1
42 . . . . . . . . . . . . . . . . -3.6900 . . . . . 71 . N . 71 . HN parsed_2lm4 1
43 . . . . . . . . . . . . . . . . 1.0400 . . . . . 73 . N . 73 . HN parsed_2lm4 1
44 . . . . . . . . . . . . . . . . -0.6100 . . . . . 74 . N . 74 . HN parsed_2lm4 1
45 . . . . . . . . . . . . . . . . -2.4300 . . . . . 75 . N . 75 . HN parsed_2lm4 1
46 . . . . . . . . . . . . . . . . -0.4400 . . . . . 76 . N . 76 . HN parsed_2lm4 1
47 . . . . . . . . . . . . . . . . -3.1400 . . . . . 85 . N . 85 . HN parsed_2lm4 1
48 . . . . . . . . . . . . . . . . -0.2400 . . . . . 87 . N . 87 . HN parsed_2lm4 1
49 . . . . . . . . . . . . . . . . 2.3500 . . . . . 88 . N . 88 . HN parsed_2lm4 1
50 . . . . . . . . . . . . . . . . 0.3800 . . . . . 89 . N . 89 . HN parsed_2lm4 1
51 . . . . . . . . . . . . . . . . 2.5300 . . . . . 92 . N . 92 . HN parsed_2lm4 1
52 . . . . . . . . . . . . . . . . 1.6000 . . . . . 93 . N . 93 . HN parsed_2lm4 1
53 . . . . . . . . . . . . . . . . 0.7800 . . . . . 94 . N . 94 . HN parsed_2lm4 1
54 . . . . . . . . . . . . . . . . 3.0600 . . . . . 96 . N . 96 . HN parsed_2lm4 1
55 . . . . . . . . . . . . . . . . 0.3200 . . . . . 97 . N . 97 . HN parsed_2lm4 1
56 . . . . . . . . . . . . . . . . 0.8900 . . . . . 98 . N . 98 . HN parsed_2lm4 1
57 . . . . . . . . . . . . . . . . 4.6300 . . . . . 99 . N . 99 . HN parsed_2lm4 1
58 . . . . . . . . . . . . . . . . 1.9100 . . . . . 100 . N . 100 . HN parsed_2lm4 1
59 . . . . . . . . . . . . . . . . 0.3400 . . . . . 101 . N . 101 . HN parsed_2lm4 1
60 . . . . . . . . . . . . . . . . 1.1800 . . . . . 102 . N . 102 . HN parsed_2lm4 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 data for yt682a" 1 1 1 22 parsed_2lm4 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
;
class=rdc1
potential=harmonic
forceconstant=0.001
coefficient 0.0 -2.33000 0.600000
;
2 1 5 33 parsed_2lm4 1
stop_
save_
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