3L4D
Crystal structure of sterol 14-alpha demethylase (CYP51) from Leishmania infantum in complex with fluconazole
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C, D (A, B, C, D) | Sterol 14-alpha demethylase | polymer | 453 | 51188.4 | 4 | UniProt (A2TEF2) Pfam (PF00067) | Leishmania infantum | |
| 2 | E, G, I, L (A, B, C, D) | PROTOPORPHYRIN IX CONTAINING FE | non-polymer | 616.5 | 4 | Chemie (HEM) | |||
| 3 | F, H, J, M (A, B, C, D) | 2-(2,4-DIFLUOROPHENYL)-1,3-DI(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-OL | non-polymer | 306.3 | 4 | Chemie (TPF) | |||
| 4 | K (C) | 3,6,9,12,15-PENTAOXATRICOSAN-1-OL | non-polymer | 350.5 | 1 | Chemie (N8E) | |||
| 5 | N, O, P, Q (A, B, C, D) | water | water | 18.0 | 61 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 32 - 480 (UniProt: A2TEF2)
| PDB | External Database | Details |
|---|---|---|
| Lys 28 | - | expression tag |
| Gly 29 | - | expression tag |
| Lys 30 | - | expression tag |
| Leu 31 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 204753.7 | |
| Non-Polymers* | Number of molecules | 9 |
| Total formula weight | 4041.5 | |
| All* | Total formula weight | 208795.2 |
