7KVQ
Human CYP3A4 bound to an inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | Cytochrome P450 3A4 | polymer | 487 | 55757.8 | 2 | UniProt (P08684) Pfam (PF00067) | Homo sapiens (Human) | 1,4-cineole 2-exo-monooxygenase,8-cineole 2-exo-monooxygenase,Albendazole monooxygenase (sulfoxide-forming),Albendazole sulfoxidase,CYPIIIA3,CYPIIIA4,Cholesterol 25-hydroxylase,Cytochrome P450 3A3,Cytochrome P450 HLp,Cytochrome P450 NF-25,Cytochrome P450-PCN1,Nifedipine oxidase,Quinine 3-monooxygenase |
| 2 | C, J (A, B) | PROTOPORPHYRIN IX CONTAINING FE | non-polymer | 616.5 | 2 | Chemie (HEM) | |||
| 3 | D (A) | SULFATE ION | non-polymer | 96.1 | 1 | Chemie (SO4) | |||
| 4 | E (A) | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
| 5 | F, G, H (A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 3 | Chemie (EDO) | |||
| 6 | I, K (A, B) | tert-butyl [(2S)-1-(naphthalen-1-yl)-3-{[(2S)-1-oxo-3-phenyl-1-{[3-(pyridin-3-yl)propyl]amino}propan-2-yl]sulfanyl}propan-2-yl]carbamate | non-polymer | 583.8 | 2 | Chemie (X7D) |
Sequence modifications
A, B: 21 - 503 (UniProt: P08684)
| PDB | External Database | Details |
|---|---|---|
| - | Leu 3 | deletion |
| - | Ile 4 | deletion |
| - | Pro 5 | deletion |
| - | Asp 6 | deletion |
| - | Leu 7 | deletion |
| - | Ala 8 | deletion |
| - | Met 9 | deletion |
| - | Glu 10 | deletion |
| - | Thr 11 | deletion |
| - | Trp 12 | deletion |
| - | Leu 13 | deletion |
| - | Leu 14 | deletion |
| - | Leu 15 | deletion |
| - | Ala 16 | deletion |
| - | Val 17 | deletion |
| - | Ser 18 | deletion |
| - | Leu 19 | deletion |
| - | Val 20 | deletion |
| - | Leu 21 | deletion |
| - | Leu 22 | deletion |
| His 504 | - | expression tag |
| His 505 | - | expression tag |
| His 506 | - | expression tag |
| His 507 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 111515.6 | |
| Non-Polymers* | Number of molecules | 9 |
| Total formula weight | 2774.9 | |
| All* | Total formula weight | 114290.5 |
