3FCI
Complex of UNG2 and a fragment-based designed inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Uracil-DNA glycosylase | polymer | 223 | 25544.1 | 1 | UniProt (P13051) Pfam (PF03167) | Homo sapiens (Human) | UDG |
| 2 | B (A) | 3-{(E)-[(3-{[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]amino}propoxy)imino]methyl}benzoic acid | non-polymer | 346.3 | 1 | Chemie (3FI) | |||
| 3 | C (A) | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
| 4 | D, E (A) | THIOCYANATE ION | non-polymer | 58.1 | 2 | Chemie (SCN) | |||
| 5 | F (A) | water | water | 18.0 | 495 | Chemie (HOH) |
Sequence modifications
A: 85 - 304 (UniProt: P13051)
| PDB | External Database | Details |
|---|---|---|
| Met 82 | - | insertion |
| Glu 83 | - | insertion |
| Phe 84 | - | insertion |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 25544.1 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 485.5 | |
| All* | Total formula weight | 26029.6 |
