6GGI
Crystal structure of CotB2 in complex with 2-fluoro-3,7,18-dolabellatriene
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) | Cyclooctat-9-en-7-ol synthase | polymer | 318 | 36770.5 | 2 | UniProt (C9K1X5) Pfam (PF19086) | Streptomyces melanosporofaciens | |
| 2 | C, D, E, F, G... (A, B) | MAGNESIUM ION | non-polymer | 24.3 | 9 | Chemie (MG) | |||
| 3 | H, T (A, B) | PYROPHOSPHATE | non-polymer | 178.0 | 2 | Chemie (PPV) | |||
| 4 | I, U (A, B) | 2-fluoro-3,7,18-dolabellatriene | non-polymer | 290.5 | 2 | Chemie (EXW) | |||
| 5 | J, V (A, B) | (4S)-2-METHYL-2,4-PENTANEDIOL | non-polymer | 118.2 | 2 | Chemie (MPD) | |||
| 6 | K, L, W (A, B) | CHLORIDE ION | non-polymer | 35.5 | 3 | Chemie (CL) | |||
| 7 | M (A) | ACETONITRILE | non-polymer | 41.1 | 1 | Chemie (CCN) | |||
| 8 | N, X (A, B) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 2 | Chemie (PEG) | |||
| 9 | O, Y (A, B) | POTASSIUM ION | non-polymer | 39.1 | 2 | Chemie (K) | |||
| 10 | AA, Z (B, A) | water | water | 18.0 | 283 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 307 (UniProt: C9K1X5)
| PDB | External Database | Details |
|---|---|---|
| Ala 308 | - | expression tag |
| Ala 309 | - | expression tag |
| Ala 310 | - | expression tag |
| Leu 311 | - | expression tag |
| Glu 312 | - | expression tag |
| His 313 | - | expression tag |
| His 314 | - | expression tag |
| His 315 | - | expression tag |
| His 316 | - | expression tag |
| His 317 | - | expression tag |
| His 318 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 73541.0 | |
| Non-Polymers* | Number of molecules | 23 |
| Total formula weight | 1829.8 | |
| All* | Total formula weight | 75370.9 |
