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Structure paper

TitleStructural Basis for Reductive Radical Formation and Electron Recycling in (R)-2-Hydroxyisocaproyl-CoA Dehydratase.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 133, Page 4342-4347, Year 2011
Publish dateJul 25, 2010 (structure data deposition date)
AuthorsKnauer, S.H. / Buckel, W. / Dobbek, H.
External linksJ. Am. Chem. Soc. / PubMed:21366233
MethodsX-ray diffraction
Resolution1.82 - 2.3 Å
Structure data

PDB-3o3m:
(R)-2-Hydroxyisocaproyl-CoA Dehydratase
Method: X-RAY DIFFRACTION / Resolution: 1.82 Å

PDB-3o3n:
(R)-2-hydroxyisocaproyl-CoA dehydratase in complex with its substrate (R)-2-hydroxyisocaproyl-CoA
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

PDB-3o3o:
(R)-2-hydroxyisocaproyl-CoA dehydratase in complex with (R)-2-hydroxyisocaproate
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-SF4:
IRON/SULFUR CLUSTER

ChemComp-SO4:
SULFATE ION

ChemComp-H2S:
HYDROSULFURIC ACID

ChemComp-HOH:
WATER

ChemComp-IRC:
S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl

ChemComp-2RH:
(2R)-2-hydroxy-4-methylpentanoic acid

Source
  • clostridium difficile (bacteria)
KeywordsLYASE / atypical Dehydratase

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