NMR-STAR data visualizer, validator, and editor

File:

data_undefined
save_entry_information
_Entry.Sf_categoryentry_information
_Entry.Sf_framecodeentry_information
_Entry.ID21037
_Entry.TitleAIP-III_DF5⏎
_Entry.Typesmall molecule structure
_Entry.Version_typenew
_Entry.Submission_date2013-07-31
_Entry.Accession_date2013-08-06
_Entry.Last_release_date2013-12-10
_Entry.Original_release_date2013-12-10
_Entry.Originationauthor
_Entry.NMR_STAR_version3.1.1.61
_Entry.Original_NMR_STAR_version3.0.9.14
_Entry.Experimental_methodNMR
_Entry.Experimental_method_subtypesolution
loop_
_Entry_author.Ordinal
_Entry_author.Given_name
_Entry_author.Family_name
_Entry_author.Middle_initials
_Entry_author.Entry_ID
1YftahTal-Gan.21037
2MonikaIvancic.21037
3GabrielCornilescu.21037
4ClaudiaCornilescuC21037
5HelenBlackwellE21037
stop_
loop_
_SG_project.SG_project_ID
_SG_project.Project_name
_SG_project.Full_name_of_center
_SG_project.Entry_ID
1not applicablenot applicable21037
stop_
loop_
_Struct_keywords.Keywords
_Struct_keywords.Entry_ID
autoinducing peptide DF521037
stop_
loop_
_Data_set.Type
_Data_set.Count
_Data_set.Entry_ID
assigned_chemical_shifts121037
stop_
loop_
_Datum.Type
_Datum.Count
_Datum.Entry_ID
1H chemical shifts5221037
stop_
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_Release.Release_number
_Release.Date
_Release.Submission_date
_Release.Type
_Release.Author
_Release.Entry_ID
12013-12-102013-07-31originalauthor21037
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loop_
BMRB21035AIP-III21037
BMRB21036AIP-III_D4A21037
BMRB21038AIP-III_DL721037
BMRB21039AIP-III_F5A cyclic peptide21037
BMRB21040AIP-III_L7A21037
BMRB21041tAIP-III21037
BMRB21042tAIP-III_D2A21037
BMRB21045AIP-I21037
BMRB21046AIP-II21037
BMRB21047AIP-IV21037
stop_
save_
save_entry_citation
_Citation.Sf_categorycitations
_Citation.Sf_framecodeentry_citation
_Citation.Entry_ID21037
_Citation.ID1
_Citation.Classentry citation
_Citation.TitleStructural Characterization of an Autoinducing Peptide and Abiotic Analogs Reveals Key Features Essential for Activation and Inhibition of an AgrC Quorum Sensing Receptor in Staphylococcus aureus
_Citation.Statussubmitted
_Citation.Typejournal
_Citation.Journal_abbrevJ. Am. Chem. Soc.
loop_
_Citation_author.Ordinal
_Citation_author.Given_name
_Citation_author.Family_name
_Citation_author.Middle_initials
_Citation_author.Entry_ID
_Citation_author.Citation_ID
1YftahTal-Gan.210371
2MonikaIvancic.210371
3GabrielCornilescu.210371
4ClaudiaCornilescuC210371
5HelenBlackwellE210371
stop_
save_
save_assembly
_Assembly.Sf_categoryassembly
_Assembly.Sf_framecodeassembly
_Assembly.Entry_ID21037
_Assembly.ID1
_Assembly.NameAIP-III_DF5
_Assembly.Number_of_components1
_Assembly.Non_standard_bondsno
_Assembly.Paramagneticno
loop_
_Entity_assembly.ID
_Entity_assembly.Entity_assembly_name
_Entity_assembly.Entity_ID
_Entity_assembly.Entity_label
_Entity_assembly.Asym_ID
_Entity_assembly.Experimental_data_reported
_Entity_assembly.Physical_state
_Entity_assembly.Conformational_isomer
_Entity_assembly.Chemical_exchange_state
_Entity_assembly.Entry_ID
_Entity_assembly.Assembly_ID
1AIP-III_DF51Jump to: $AIP-III_DF5Ayesnativenono210371
stop_
loop_
_Bond.ID
_Bond.Type
_Bond.Value_order
_Bond.Entity_assembly_ID_1
_Bond.Entity_assembly_name_1
_Bond.Entity_ID_1
_Bond.Comp_ID_1
_Bond.Comp_index_ID_1
_Bond.Seq_ID_1
_Bond.Atom_ID_1
_Bond.Entity_assembly_ID_2
_Bond.Entity_assembly_name_2
_Bond.Entity_ID_2
_Bond.Comp_ID_2
_Bond.Comp_index_ID_2
_Bond.Seq_ID_2
_Bond.Atom_ID_2
_Bond.Auth_seq_ID_1
_Bond.Auth_comp_ID_1
_Bond.Auth_seq_ID_2
_Bond.Auth_comp_ID_2
_Bond.Entry_ID
_Bond.Assembly_ID
1Thioestersing1AIP-III_DF51LEU77C1AIP-III_DF51CYS33SG7LEU3CYS210371
stop_
save_
save_AIP-III_DF5
_Entity.Sf_categoryentity
_Entity.Sf_framecodeAIP-III_DF5
_Entity.Entry_ID21037
_Entity.ID1
_Entity.NameAIP-III_DF5
_Entity.Typepolymer
_Entity.Polymer_typepolypeptide(L)
_Entity.Polymer_strand_IDA
_Entity.Polymer_seq_one_letter_codeINCDXLL
_Entity.Polymer_author_seq_detailsPhe5 is not a L-amino acid, it is a D-amino acid
_Entity.Ambiguous_conformational_statesno
_Entity.Ambiguous_chem_comp_sitesno
_Entity.Nstd_monomeryes
_Entity.Nstd_chiralityyes
_Entity.Nstd_linkageno
_Entity.Number_of_monomers7
_Entity.Paramagneticno
_Entity.Thiol_stateall other bound
_Entity.Src_methodman
_Entity.MutationF5 is D-form not L-form
_Entity.Formula_weight818
loop_
_Entity_comp_index.ID
_Entity_comp_index.Auth_seq_ID
_Entity_comp_index.Comp_ID
_Entity_comp_index.Entry_ID
_Entity_comp_index.Entity_ID
11ILE210371
22ASN210371
33CYS210371
44ASP210371
55DPN210371
66LEU210371
77LEU210371
stop_
loop_
_Entity_poly_seq.Mon_ID
_Entity_poly_seq.Num
_Entity_poly_seq.Comp_index_ID
_Entity_poly_seq.Entry_ID
_Entity_poly_seq.Entity_ID
ILE11210371
ASN22210371
CYS33210371
ASP44210371
DPN55210371
LEU66210371
LEU77210371
stop_
save_