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TitleStructural characterization and high-throughput screening of inhibitors of PvdQ, an NTN hydrolase involved in pyoverdine synthesis.
Journal, issue, pagesAcs Chem. Biol., Vol. 6, Page 1277-1286, Year 2011
Publish dateJan 4, 2010 (structure data deposition date)
AuthorsDrake, E.J. / Gulick, A.M.
External linksAcs Chem. Biol. / PubMed:21892836
MethodsX-ray diffraction
Resolution1.66 - 2.3 Å
Structure data

PDB-3l91:
Structure of Pseudomonas aerugionsa PvdQ bound to octanoate
Method: X-RAY DIFFRACTION / Resolution: 1.66 Å

PDB-3l94:
Structure of PvdQ covalently acylated with myristate
Method: X-RAY DIFFRACTION / Resolution: 1.95 Å

PDB-3sra:
Structure of Pseudomonas aerugionsa PvdQ covalently acylated with myristic acid from PVDIq
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

PDB-3srb:
Structure of Pseudomonas aeruginosa PvdQ bound to SMER28
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-3src:
Structure of Pseudomonas aeruginosa PvdQ bound to NS2028
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-OCA:
OCTANOIC ACID (CAPRYLIC ACID)

ChemComp-HOH:
WATER

ChemComp-MYR:
MYRISTIC ACID

ChemComp-SO4:
SULFATE ION

ChemComp-28S:
6-bromo-N-(prop-2-en-1-yl)quinazolin-4-amine

ChemComp-28N:
8-bromo-4H-[1,2,4]oxadiazolo[3,4-c][1,4]benzoxazin-1-one

Source
  • pseudomonas aeruginosa (bacteria)
  • pseudomonas aeruginosa pao1 (bacteria)
KeywordsHYDROLASE / PvdQ / pyoverdine / acylase / NTN Hydrolase / Quorum sensing / Zymogen / nrps tailoring / HYDROLASE/HYDROLASE INHIBITOR / liganded / HYDROLASE-HYDROLASE INHIBITOR complex

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