NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type |
|
|
34196 |
1jjg   |
5077 | cing | recoord | 2-parsed | STAR | comment |
data_1jjg_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_1jjg
_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_1jjg 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_1jjg
_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 1jjg "Master copy" parsed_1jjg
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_1jjg
_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 1jjg.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_1jjg 1
1 1jjg.mr . . XPLOR/CNS 2 distance "hydrogen bond" simple 48 parsed_1jjg 1
1 1jjg.mr . . XPLOR/CNS 3 distance NOE simple 328 parsed_1jjg 1
1 1jjg.mr . . n/a 4 comment "Not applicable" "Not applicable" 0 parsed_1jjg 1
1 1jjg.mr . . XPLOR/CNS 5 "dihedral angle" "Not applicable" "Not applicable" 66 parsed_1jjg 1
1 1jjg.mr . . n/a 6 comment "Not applicable" "Not applicable" 0 parsed_1jjg 1
1 1jjg.mr . . STAR 7 sequence "Not applicable" "Not applicable" 0 parsed_1jjg 1
1 1jjg.mr . . n/a 8 "chemical shift" "Not applicable" "format 3" 0 parsed_1jjg 1
1 1jjg.mr . . n/a 9 comment "Not applicable" "Not applicable" 0 parsed_1jjg 1
1 1jjg.mr . . "MR format" 10 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_1jjg 1
stop_
save_
save_MR_file_comment_9
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_1jjg
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 9
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
# The following loop is used to define sets of Atom-shift assignment IDs that
# represent related ambiguous assignments taken from the above list of
# assigned chemical shifts. Each element in the set should be separated by a
"# comma, as shown in the example below, and is the assignment ID for a chemical"
# shift assignment that has been given as ambiguity code of 4 or 5. Each set
# indicates that the observed chemical shifts are related to the defined
"# atoms, but have not been assigned uniquely to a specific atom in the set."
loop_
_Atom_shift_assign_ID_ambiguity
#
# Sets of Atom-shift Assignment Ambiguities
#
# ------------------------------------------
"# Example: 5,4,7"
#
@
stop_
;
save_
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