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TitleStructure of PA1221, a Nonribosomal Peptide Synthetase Containing Adenylation and Peptidyl Carrier Protein Domains.
Journal, issue, pagesBiochemistry, Vol. 51, Page 3252-3263, Year 2012
Publish dateJan 25, 2012 (structure data deposition date)
AuthorsMitchell, C.A. / Shi, C. / Aldrich, C.C. / Gulick, A.M.
External linksBiochemistry / PubMed:22452656
MethodsX-ray diffraction
Resolution2.15 - 2.55 Å
Structure data

PDB-4dg8:
Structure of PA1221, an NRPS protein containing adenylation and PCP domains
Method: X-RAY DIFFRACTION / Resolution: 2.15 Å

PDB-4dg9:
Structure of holo-PA1221, an NRPS protein containing adenylation and PCP domains bound to vinylsulfonamide inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.55 Å

Chemicals

ChemComp-AMP:
ADENOSINE MONOPHOSPHATE / AMP*YM

ChemComp-BU3:
(R,R)-2,3-BUTANEDIOL

ChemComp-HOH:
WATER

ChemComp-DG9:
5'-({[(2R,3R)-3-amino-2-{[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-{[oxido(oxo)phosphonio]oxy}butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}-4-methylpentyl]sulfonyl}amino)-5'-deoxyadenosine

Source
  • pseudomonas aeruginosa (bacteria)
KeywordsLIGASE / ANL Superfamily / Adenylation domain / peptidyl carrier protein / Non-ribosomal peptide synthetase / NRPS / valine adenylation / LIGASE/Inhibitor / pantetheine / vinylsulfonamide / LIGASE-Inhibitor complex

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