6UNK
Human CYP3A4 bound to an inhibitor
Summary for 6UNK
Entry DOI | 10.2210/pdb6unk/pdb |
Related | 6UHI 6UHJ 6UNE 6UNG 6UNH |
Descriptor | Cytochrome P450 3A4, PROTOPORPHYRIN IX CONTAINING FE, tert-butyl [(2S)-1-(naphthalen-1-yl)-3-{[(2R)-1-oxo-3-phenyl-1-{[2-(pyridin-3-yl)ethyl]amino}propan-2-yl]sulfanyl}propan-2-yl]carbamate (3 entities in total) |
Functional Keywords | cyp3a4, inhibitor, complex, oxidoreductase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 56944.06 |
Authors | Sevrioukova, I.F. (deposition date: 2019-10-12, release date: 2020-02-05, Last modification date: 2023-10-11) |
Primary citation | Samuels, E.R.,Sevrioukova, I.F. An increase in side-group hydrophobicity largely improves the potency of ritonavir-like inhibitors of CYP3A4. Bioorg.Med.Chem., 28:115349-115349, 2020 Cited by PubMed: 32044230DOI: 10.1016/j.bmc.2020.115349 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.75 Å) |
Structure validation
Download full validation report