7DP5
Crystal structure of mutant V45A Brugia malayi thymidylate synthase complexed with 2'-deoxyuridine monophosphate and methotrexate
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Thymidylate synthase | polymer | 306 | 34494.4 | 1 | UniProt (A0A4E9EZW9) Pfam (PF00303) UniProt (by SIFTS) (A0A1P6CBU1) | Brugia malayi (Filarial nematode worm) | |
| 2 | B (A) | 2'-DEOXYURIDINE 5'-MONOPHOSPHATE | non-polymer | 308.2 | 1 | Chemie (UMP) | |||
| 3 | C (A) | METHOTREXATE | non-polymer | 454.4 | 1 | Chemie (MTX) | |||
| 4 | D, E (A) | BETA-MERCAPTOETHANOL | non-polymer | 78.1 | 2 | Chemie (BME) | |||
| 5 | F, G (A) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) | |||
| 6 | H (A) | water | water | 18.0 | 253 | Chemie (HOH) |
Sequence modifications
A: 1 - 306 (UniProt: A0A4E9EZW9)
| PDB | External Database | Details |
|---|---|---|
| Ala 45 | Val 45 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 34494.4 | |
| Non-Polymers* | Number of molecules | 6 |
| Total formula weight | 1103.1 | |
| All* | Total formula weight | 35597.5 |
