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TitleInteraction of CYP3A4 with caffeine: First insights into multiple substrate binding.
Journal, issue, pagesJ. Biol. Chem., Vol. 299, Page 105117-105117, Year 2023
Publish dateApr 28, 2023 (structure data deposition date)
AuthorsSevrioukova, I.F.
External linksJ. Biol. Chem. / PubMed:37524132
MethodsX-ray diffraction
Resolution2.05 - 2.15 Å
Structure data

PDB-8so1:
Human CYP3A4 bound to three caffeine molecules
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

PDB-8so2:
Human CYP3A4 bound to a substrate
Method: X-RAY DIFFRACTION / Resolution: 2.15 Å

Chemicals

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-CFF:
CAFFEINE / medication*YM

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsOXIDOREDUCTASE/SUBSTRATE / substrate / complex / OXIDOREDUCTASE / OXIDOREDUCTASE-SUBSTRATE complex

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