NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | item_count |
|
|
48410 |
2ixy   |
cing | 2-parsed | STAR | dipolar coupling | 28 |
data_2ixy_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ixy
_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_2ixy 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ixy
_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 2ixy "Master copy" parsed_2ixy
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ixy
_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 2ixy.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ixy 1
1 2ixy.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 30 parsed_2ixy 1
1 2ixy.mr . . XPLOR/CNS 3 distance NOE simple 266 parsed_2ixy 1
1 2ixy.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_2ixy 1
1 2ixy.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 160 parsed_2ixy 1
1 2ixy.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 28 parsed_2ixy 1
1 2ixy.mr . . unknown 7 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2ixy 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_6
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2ixy
_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 . . . . . . . . . . . . . . . . -5.500 . . . . LO3 2 . C1' LO3 2 . H1' parsed_2ixy 1
2 . . . . . . . . . . . . . . . . -29.430 . . . . LO3 4 . C1' LO3 4 . H1' parsed_2ixy 1
3 . . . . . . . . . . . . . . . . -21.230 . . . . LO3 5 . C1' LO3 5 . H1' parsed_2ixy 1
4 . . . . . . . . . . . . . . . . -20.950 . . . . LO3 6 . C1' LO3 6 . H1' parsed_2ixy 1
5 . . . . . . . . . . . . . . . . -1.700 . . . . LO3 7 . C1' LO3 7 . H1' parsed_2ixy 1
6 . . . . . . . . . . . . . . . . -25.390 . . . . LO3 17 . C1' LO3 17 . H1' parsed_2ixy 1
7 . . . . . . . . . . . . . . . . -1.800 . . . . LO3 18 . C1' LO3 18 . H1' parsed_2ixy 1
8 . . . . . . . . . . . . . . . . -7.170 . . . . LO3 19 . C1' LO3 19 . H1' parsed_2ixy 1
9 . . . . . . . . . . . . . . . . -31.150 . . . . LO3 20 . C1' LO3 20 . H1' parsed_2ixy 1
10 . . . . . . . . . . . . . . . . 4.130 . . . . LO3 8 . C2 LO3 8 . H2 parsed_2ixy 1
11 . . . . . . . . . . . . . . . . 17.910 . . . . LO3 9 . C2 LO3 9 . H2 parsed_2ixy 1
12 . . . . . . . . . . . . . . . . 13.890 . . . . LO3 3 . C5 LO3 3 . H5 parsed_2ixy 1
13 . . . . . . . . . . . . . . . . 2.550 . . . . LO3 5 . C5 LO3 5 . H5 parsed_2ixy 1
14 . . . . . . . . . . . . . . . . -19.040 . . . . LO3 7 . C5 LO3 7 . H5 parsed_2ixy 1
15 . . . . . . . . . . . . . . . . 17.280 . . . . LO3 18 . C5 LO3 18 . H5 parsed_2ixy 1
16 . . . . . . . . . . . . . . . . 0.180 . . . . LO3 26 . C5 LO3 26 . H5 parsed_2ixy 1
17 . . . . . . . . . . . . . . . . 5.410 . . . . LO3 4 . C6 LO3 4 . H6 parsed_2ixy 1
18 . . . . . . . . . . . . . . . . 27.210 . . . . LO3 5 . C6 LO3 5 . H6 parsed_2ixy 1
19 . . . . . . . . . . . . . . . . 11.100 . . . . LO3 6 . C6 LO3 6 . H6 parsed_2ixy 1
20 . . . . . . . . . . . . . . . . 31.730 . . . . LO3 19 . C6 LO3 19 . H6 parsed_2ixy 1
21 . . . . . . . . . . . . . . . . -15.240 . . . . LO3 2 . C8 LO3 2 . H8 parsed_2ixy 1
22 . . . . . . . . . . . . . . . . -0.440 . . . . LO3 8 . C8 LO3 8 . H8 parsed_2ixy 1
23 . . . . . . . . . . . . . . . . 2.490 . . . . LO3 10 . C8 LO3 10 . H8 parsed_2ixy 1
24 . . . . . . . . . . . . . . . . 20.480 . . . . LO3 20 . C8 LO3 20 . H8 parsed_2ixy 1
25 . . . . . . . . . . . . . . . . 14.710 . . . . LO3 21 . C8 LO3 21 . H8 parsed_2ixy 1
26 . . . . . . . . . . . . . . . . 14.910 . . . . LO3 22 . C8 LO3 22 . H8 parsed_2ixy 1
27 . . . . . . . . . . . . . . . . 15.330 . . . . LO3 24 . C8 LO3 24 . H8 parsed_2ixy 1
28 . . . . . . . . . . . . . . . . 7.620 . . . . LO3 25 . C8 LO3 25 . H8 parsed_2ixy 1
stop_
save_
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