NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | item_count |
|
|
534147 |
2lpk   |
18263 | cing | 2-parsed | STAR | dipolar coupling | 58 |
data_2lpk_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2lpk
_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_2lpk 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2lpk
_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 2lpk "Master copy" parsed_2lpk
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2lpk
_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 2lpk.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2lpk 1
1 2lpk.mr . . XPLOR/CNS 2 distance NOE simple 1792 parsed_2lpk 1
1 2lpk.mr . . XPLOR/CNS 3 "dihedral angle" "Not applicable" "Not applicable" 144 parsed_2lpk 1
1 2lpk.mr . . XPLOR/CNS 4 "dipolar coupling" "Not applicable" "Not applicable" 58 parsed_2lpk 1
1 2lpk.mr . . XPLOR/CNS 5 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2lpk 1
1 2lpk.mr . . XPLOR/CNS 6 distance "hydrogen bond" simple 0 parsed_2lpk 1
1 2lpk.mr . . XPLOR/CNS 7 distance NOE simple 0 parsed_2lpk 1
1 2lpk.mr . . "MR format" 8 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2lpk 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_4
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2lpk
_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 . . . . . . . . . . . . . . . . 6.1210 . . . . . 7 . N . 7 . HN parsed_2lpk 1
2 . . . . . . . . . . . . . . . . -9.7620 . . . . . 8 . N . 8 . HN parsed_2lpk 1
3 . . . . . . . . . . . . . . . . 0.2340 . . . . . 9 . N . 9 . HN parsed_2lpk 1
4 . . . . . . . . . . . . . . . . 9.2290 . . . . . 10 . N . 10 . HN parsed_2lpk 1
5 . . . . . . . . . . . . . . . . 4.4520 . . . . . 11 . N . 11 . HN parsed_2lpk 1
6 . . . . . . . . . . . . . . . . -4.2750 . . . . . 12 . N . 12 . HN parsed_2lpk 1
7 . . . . . . . . . . . . . . . . -0.2190 . . . . . 13 . N . 13 . HN parsed_2lpk 1
8 . . . . . . . . . . . . . . . . 10.7040 . . . . . 14 . N . 14 . HN parsed_2lpk 1
9 . . . . . . . . . . . . . . . . -7.4750 . . . . . 15 . N . 15 . HN parsed_2lpk 1
10 . . . . . . . . . . . . . . . . -10.0530 . . . . . 16 . N . 16 . HN parsed_2lpk 1
11 . . . . . . . . . . . . . . . . 15.3680 . . . . . 17 . N . 17 . HN parsed_2lpk 1
12 . . . . . . . . . . . . . . . . 20.9820 . . . . . 18 . N . 18 . HN parsed_2lpk 1
13 . . . . . . . . . . . . . . . . -8.6710 . . . . . 20 . N . 20 . HN parsed_2lpk 1
14 . . . . . . . . . . . . . . . . 0.6800 . . . . . 21 . N . 21 . HN parsed_2lpk 1
15 . . . . . . . . . . . . . . . . -16.6520 . . . . . 22 . N . 22 . HN parsed_2lpk 1
16 . . . . . . . . . . . . . . . . -2.9720 . . . . . 23 . N . 23 . HN parsed_2lpk 1
17 . . . . . . . . . . . . . . . . 2.4340 . . . . . 26 . N . 26 . HN parsed_2lpk 1
18 . . . . . . . . . . . . . . . . 0.7880 . . . . . 27 . N . 27 . HN parsed_2lpk 1
19 . . . . . . . . . . . . . . . . 16.1330 . . . . . 28 . N . 28 . HN parsed_2lpk 1
20 . . . . . . . . . . . . . . . . 19.2700 . . . . . 29 . N . 29 . HN parsed_2lpk 1
21 . . . . . . . . . . . . . . . . -6.7560 . . . . . 30 . N . 30 . HN parsed_2lpk 1
22 . . . . . . . . . . . . . . . . 15.1430 . . . . . 33 . N . 33 . HN parsed_2lpk 1
23 . . . . . . . . . . . . . . . . -8.2840 . . . . . 34 . N . 34 . HN parsed_2lpk 1
24 . . . . . . . . . . . . . . . . -3.9790 . . . . . 36 . N . 36 . HN parsed_2lpk 1
25 . . . . . . . . . . . . . . . . 22.0200 . . . . . 38 . N . 38 . HN parsed_2lpk 1
26 . . . . . . . . . . . . . . . . 0.7160 . . . . . 44 . N . 44 . HN parsed_2lpk 1
27 . . . . . . . . . . . . . . . . 14.2090 . . . . . 45 . N . 45 . HN parsed_2lpk 1
28 . . . . . . . . . . . . . . . . 18.1920 . . . . . 49 . N . 49 . HN parsed_2lpk 1
29 . . . . . . . . . . . . . . . . 13.2530 . . . . . 50 . N . 50 . HN parsed_2lpk 1
30 . . . . . . . . . . . . . . . . 3.0420 . . . . . 51 . N . 51 . HN parsed_2lpk 1
31 . . . . . . . . . . . . . . . . 11.1250 . . . . . 52 . N . 52 . HN parsed_2lpk 1
32 . . . . . . . . . . . . . . . . -5.6380 . . . . . 57 . N . 57 . HN parsed_2lpk 1
33 . . . . . . . . . . . . . . . . 4.5160 . . . . . 58 . N . 58 . HN parsed_2lpk 1
34 . . . . . . . . . . . . . . . . 0.4220 . . . . . 59 . N . 59 . HN parsed_2lpk 1
35 . . . . . . . . . . . . . . . . 10.4170 . . . . . 62 . N . 62 . HN parsed_2lpk 1
36 . . . . . . . . . . . . . . . . -1.4980 . . . . . 65 . N . 65 . HN parsed_2lpk 1
37 . . . . . . . . . . . . . . . . 3.5270 . . . . . 66 . N . 66 . HN parsed_2lpk 1
38 . . . . . . . . . . . . . . . . -1.9580 . . . . . 67 . N . 67 . HN parsed_2lpk 1
39 . . . . . . . . . . . . . . . . -3.8150 . . . . . 69 . N . 69 . HN parsed_2lpk 1
40 . . . . . . . . . . . . . . . . -1.0510 . . . . . 70 . N . 70 . HN parsed_2lpk 1
41 . . . . . . . . . . . . . . . . 4.7040 . . . . . 72 . N . 72 . HN parsed_2lpk 1
42 . . . . . . . . . . . . . . . . -4.1090 . . . . . 73 . N . 73 . HN parsed_2lpk 1
43 . . . . . . . . . . . . . . . . 8.3570 . . . . . 74 . N . 74 . HN parsed_2lpk 1
44 . . . . . . . . . . . . . . . . -4.7970 . . . . . 75 . N . 75 . HN parsed_2lpk 1
45 . . . . . . . . . . . . . . . . 11.8580 . . . . . 76 . N . 76 . HN parsed_2lpk 1
46 . . . . . . . . . . . . . . . . 14.9530 . . . . . 78 . N . 78 . HN parsed_2lpk 1
47 . . . . . . . . . . . . . . . . 20.4670 . . . . . 79 . N . 79 . HN parsed_2lpk 1
48 . . . . . . . . . . . . . . . . 14.9970 . . . . . 81 . N . 81 . HN parsed_2lpk 1
49 . . . . . . . . . . . . . . . . 15.9770 . . . . . 82 . N . 82 . HN parsed_2lpk 1
50 . . . . . . . . . . . . . . . . 17.3140 . . . . . 84 . N . 84 . HN parsed_2lpk 1
51 . . . . . . . . . . . . . . . . 14.5850 . . . . . 85 . N . 85 . HN parsed_2lpk 1
52 . . . . . . . . . . . . . . . . 19.4500 . . . . . 86 . N . 86 . HN parsed_2lpk 1
53 . . . . . . . . . . . . . . . . 21.4800 . . . . . 87 . N . 87 . HN parsed_2lpk 1
54 . . . . . . . . . . . . . . . . 13.7060 . . . . . 88 . N . 88 . HN parsed_2lpk 1
55 . . . . . . . . . . . . . . . . 14.5360 . . . . . 89 . N . 89 . HN parsed_2lpk 1
56 . . . . . . . . . . . . . . . . 22.5840 . . . . . 90 . N . 90 . HN parsed_2lpk 1
57 . . . . . . . . . . . . . . . . 15.7400 . . . . . 91 . N . 91 . HN parsed_2lpk 1
58 . . . . . . . . . . . . . . . . 6.2840 . . . . . 92 . N . 92 . HN parsed_2lpk 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
;
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name Z )
( resid 600 and name Z )
( resid 61 and name N )
( resid 61 and name HN ) 23.4750 4.0130
;
205 1 210 60 parsed_2lpk 1
stop_
save_
Contact the webmaster for help, if required. Sunday, April 28, 2024 9:21:40 PM GMT (wattos1)