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 |
|
|
533421 |
2ksq   |
cing | 2-parsed | STAR | dipolar coupling | 9 |
data_2ksq_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2ksq
_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_2ksq 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2ksq
_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 2ksq "Master copy" parsed_2ksq
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2ksq
_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 2ksq.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 2 distance NOE ambi 848 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 3 distance "hydrogen bond" simple 154 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 4 distance NOE simple 138 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 5 distance "hydrogen bond" simple 154 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 6 "dipolar coupling" "Not applicable" "Not applicable" 79 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 7 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 8 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 9 "dipolar coupling" "Not applicable" "Not applicable" 66 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 10 "dipolar coupling" "Not applicable" "Not applicable" 9 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 11 unknown "Not applicable" "Not applicable" 0 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 12 "dihedral angle" "Not applicable" "Not applicable" 0 parsed_2ksq 1
1 2ksq.mr . . XPLOR/CNS 13 "dipolar coupling" "Not applicable" "Not applicable" 0 parsed_2ksq 1
1 2ksq.mr . . "MR format" 14 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2ksq 1
stop_
save_
save_CNS/XPLOR_dipolar_coupling_10
_RDC_constraint_list.Sf_category RDC_constraints
_RDC_constraint_list.Entry_ID parsed_2ksq
_RDC_constraint_list.ID 1
_RDC_constraint_list.Constraint_file_ID 1
_RDC_constraint_list.Block_ID 10
_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 . . . . . . . . . . . . . . . . 0.620 . . . . . 3 . N . 3 . HN parsed_2ksq 1
2 . . . . . . . . . . . . . . . . 6.440 . . . . . 4 . N . 4 . HN parsed_2ksq 1
3 . . . . . . . . . . . . . . . . -5.900 . . . . . 5 . N . 5 . HN parsed_2ksq 1
4 . . . . . . . . . . . . . . . . -13.680 . . . . . 6 . N . 6 . HN parsed_2ksq 1
5 . . . . . . . . . . . . . . . . 0.500 . . . . . 8 . N . 8 . HN parsed_2ksq 1
6 . . . . . . . . . . . . . . . . -26.460 . . . . . 9 . N . 9 . HN parsed_2ksq 1
7 . . . . . . . . . . . . . . . . -14.780 . . . . . 10 . N . 10 . HN parsed_2ksq 1
8 . . . . . . . . . . . . . . . . 9.060 . . . . . 11 . N . 11 . HN parsed_2ksq 1
9 . . . . . . . . . . . . . . . . -4.940 . . . . . 12 . N . 12 . HN parsed_2ksq 1
stop_
save_
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