4I4H
Crystal structure of CYP3A4 ligated to pyridine-substituted desoxyritonavir
Summary for 4I4H
Entry DOI | 10.2210/pdb4i4h/pdb |
Related | 3NXU 4I4G |
Descriptor | Cytochrome P450 3A4, PROTOPORPHYRIN IX CONTAINING FE, pyridin-3-ylmethyl [(2R,5S)-5-{[N-(methyl{[2-(propan-2-yl)-1,3-thiazol-4-yl]methyl}carbamoyl)-D-valyl]amino}-1,6-diphenylhexan-2-yl]carbamate (3 entities in total) |
Functional Keywords | monooxygenase, cytochrome p450 reductase, cytochrome b5, endoplasmic reticulum, cytochrome p450, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Endoplasmic reticulum membrane; Single-pass membrane protein: P08684 |
Total number of polymer chains | 1 |
Total formula weight | 57073.22 |
Authors | Sevrioukova, I.F.,Poulos, T.L. (deposition date: 2012-11-27, release date: 2013-04-24, Last modification date: 2023-09-20) |
Primary citation | Sevrioukova, I.F.,Poulos, T.L. Pyridine-Substituted Desoxyritonavir Is a More Potent Inhibitor of Cytochrome P450 3A4 than Ritonavir. J.Med.Chem., 56:3733-3741, 2013 Cited by PubMed: 23586711DOI: 10.1021/jm400288z PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.9 Å) |
Structure validation
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