6PU7
Human IDO1 in complex with compound 17 (N-{2-[(4-{N-[(7S)-4-fluorobicyclo[4.2.0]octa-1,3,5-trien-7-yl]-N'-hydroxycarbamimidoyl}-1,2,5-oxadiazol-3-yl)sulfanyl]ethyl}acetamide)
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) | Indoleamine 2,3-dioxygenase 1 | polymer | 393 | 44298.1 | 2 | UniProt (P14902) Pfam (PF01231) | Homo sapiens (Human) | IDO-1,Indoleamine-pyrrole 2,3-dioxygenase |
| 2 | C, E (A, B) | PROTOPORPHYRIN IX CONTAINING FE | non-polymer | 616.5 | 2 | Chemie (HEM) | |||
| 3 | D, F (A, B) | N-{2-[(4-{N-[(7S)-4-fluorobicyclo[4.2.0]octa-1,3,5-trien-7-yl]-N'-hydroxycarbamimidoyl}-1,2,5-oxadiazol-3-yl)sulfanyl]ethyl}acetamide | non-polymer | 365.4 | 2 | Chemie (OY4) | |||
| 4 | G, H (A, B) | water | water | 18.0 | 215 | Chemie (HOH) |
Sequence modifications
A, B: 11 - 402 (UniProt: P14902)
| PDB | External Database | Details |
|---|---|---|
| Met 10 | - | initiating methionine |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 88596.1 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1963.7 | |
| All* | Total formula weight | 90559.8 |
