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Structure paper

TitleA Structural Snapshot of CYP2B4 in Complex with Paroxetine Provides Insights into Ligand Binding and Clusters of Conformational States.
Journal, issue, pagesJ. Pharmacol. Exp. Ther., Vol. 346, Page 113-120, Year 2013
Publish dateMar 13, 2013 (structure data deposition date)
AuthorsShah, M.B. / Kufareva, I. / Pascual, J. / Zhang, Q. / Stout, C.D. / Halpert, J.R.
External linksJ. Pharmacol. Exp. Ther. / PubMed:23633618
MethodsX-ray diffraction
Resolution2.14 Å
Structure data

PDB-4jlt:
Crystal structure of P450 2B4(H226Y) in complex with paroxetine
Method: X-RAY DIFFRACTION / Resolution: 2.14 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-CM5:
5-CYCLOHEXYL-1-PENTYL-BETA-D-MALTOSIDE / detergent*YM

ChemComp-8PR:
Paroxetine

ChemComp-SO4:
SULFATE ION

ChemComp-GOL:
GLYCEROL

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

Source
  • oryctolagus cuniculus (rabbit)
KeywordsOXIDOREDUCTASE / P450 / cytochrome P450 2B4 / monooxygenase / ME protein / CYP 2B4

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