3OX3
X-ray Structural study of quinone reductase II inhibition by compounds with micromolar to nanomolar range IC50 values
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) | Ribosyldihydronicotinamide dehydrogenase [quinone] | polymer | 231 | 25980.5 | 2 | UniProt (P16083) Pfam (PF02525) | Homo sapiens (human) | NRH dehydrogenase [quinone] 2, NRH:quinone oxidoreductase 2, Quinone reductase 2, QR2 |
| 2 | C, F (A, B) | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
| 3 | D, G (A, B) | FLAVIN-ADENINE DINUCLEOTIDE | non-polymer | 785.5 | 2 | Chemie (FAD) | |||
| 4 | E, H (A, B) | N-[2-(2-methoxy-1H-dipyrido[2,3-a:3',2'-e]pyrrolizin-11-yl)ethyl]furan-2-carboxamide | non-polymer | 374.4 | 2 | Chemie (4X4) | |||
| 5 | I, J (A, B) | water | water | 18.0 | 393 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 51961.1 | |
| Non-Polymers* | Number of molecules | 6 |
| Total formula weight | 2450.7 | |
| All* | Total formula weight | 54411.8 |
