4B0C

Crystal Structure of 3-hydroxydecanoyl-Acyl Carrier Protein Dehydratase (FabA) from Pseudomonas aeruginosa in complex with 3-(pentylthio)-4H-1,2,4-triazole

Summary for 4B0C

Related4B0B 4B0I 4B8U 4FQ9
Descriptor3-HYDROXYDECANOYL-[ACYL-CARRIER-PROTEIN] DEHYDRATASE, 5-(pentylsulfanyl)-1H-1,2,4-triazole (3 entities in total)
Functional Keywordslyase, fatty acid biosynthesis, bacterial virulence, drug discovery
Biological sourcePSEUDOMONAS AERUGINOSA
Cellular locationCytoplasm (By similarity) O33877
Total number of polymer chains5
Total molecular weight94698.98
Authors
Moynie, L.,McMahon, S.A.,Duthie, F.G.,Naismith, J.H. (deposition date: 2012-07-01, release date: 2012-11-28, Last modification date: 2013-01-16)
Primary citation
Moynie, L.,Leckie, S.M.,Mcmahon, S.A.,Duthie, F.G.,Koehnke, A.,Taylor, J.W.,Alphey, M.S.,Brenk, R.,Smith, A.D.,Naismith, J.H.
Structural Insights Into the Mechanism and Inhibition of the Beta-Hydroxydecanoyl-Acyl Carrier Protein Dehydratase from Pseudomonasaeruginosa.
J.Mol.Biol., 425:365-, 2013
PubMed: 23174186 (PDB entries with the same primary citation)
DOI: 10.1016/J.JMB.2012.11.017
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.7 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.228501.9%4.6%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution