9C7M
Crystal structure of pentalenene synthase variant F76A complexed with 12,13-difluorofarnesyl diphosphate
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) | Pentalenene synthase | polymer | 337 | 37974.3 | 2 | UniProt (Q55012) Pfam (PF19086) | Streptomyces exfoliatus | PS,Pentalenolactone biosynthesis protein A,Sesquiterpene cyclase,Sesquiterpene synthase |
| 2 | C (A) | (2E,6E)-12-fluoro-11-(fluoromethyl)-3,7-dimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate | non-polymer | 418.3 | 1 | Chemie (FDF) | |||
| 3 | D, E, F (A) | MAGNESIUM ION | non-polymer | 24.3 | 3 | Chemie (MG) | |||
| 4 | G, H (A, B) | water | water | 18.0 | 54 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 337 (UniProt: Q55012)
| PDB | External Database | Details |
|---|---|---|
| Ala 76 | Phe 76 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 75948.6 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 491.2 | |
| All* | Total formula weight | 76439.9 |
