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TitleThe Molecular Basis for Inhibition of BphD, a C-C Bond Hydrolase Involved in Polychlorinated Biphenyls Degradation: LARGE 3-SUBSTITUENTS PREVENT TAUTOMERIZATION.
Journal, issue, pagesJ. Biol. Chem., Vol. 282, Page 36377-36385, Year 2007
Publish dateOct 9, 2007 (structure data deposition date)
AuthorsBhowmik, S. / Horsman, G.P. / Bolin, J.T. / Eltis, L.D.
External linksJ. Biol. Chem. / PubMed:17932031
MethodsX-ray diffraction
Resolution1.57 - 1.7 Å
Structure data

PDB-2rht:
Crystal Structure of the S112A mutant of a C-C hydrolase, BphD from Burkholderia xenovorans LB400, in complex with 3-Cl HOPDA
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

PDB-2rhw:
Crystal Structure of the S112A mutant of a C-C hydrolase, BphD from Burkholderia xenovorans LB400, in complex with 3,10-Di-Fluoro HOPDA
Method: X-RAY DIFFRACTION / Resolution: 1.57 Å

Chemicals

ChemComp-NA:
Unknown entry

ChemComp-C1E:
(2Z,4E)-3-chloro-2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoic acid

ChemComp-MLI:
MALONATE ION

ChemComp-HOH:
WATER

ChemComp-C0E:
3-fluoro-6-(4-fluorophenyl)-2-hydroxy-6-oxohexa-2,4-dienoic acid

Source
  • burkholderia xenovorans (bacteria)
KeywordsHYDROLASE / C-C bond hydrolase / Aromatic hydrocarbons catabolism

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