7L8H
EV68 3C protease (3Cpro) in Complex with Rupintrivir
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B | 3C Protease | polymer | 189 | 20801.6 | 2 | UniProt (A0A2K8BQT2) Pfam (PF00548) UniProt (by SIFTS) (A0A097BW12) In PDB | Human enterovirus D68 (EV68) | Peptidase C3 |
| 2 | A, B | 4-{2-(4-FLUORO-BENZYL)-6-METHYL-5-[(5-METHYL-ISOXAZOLE-3-CARBONYL)-AMINO]-4-OXO-HEPTANOYLAMINO}-5-(2-OXO-PYRROLIDIN-3-YL)-PENTANOIC ACID ETHYL ESTER | non-polymer | 600.7 | 2 | Chemie (AG7) | |||
| 3 | water | water | 18.0 | 281 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 183 (UniProt: A0A2K8BQT2)
| PDB | External Database | Details |
|---|---|---|
| Gly -5 | - | expression tag |
| Ser -4 | - | expression tag |
| His -3 | - | expression tag |
| Met -2 | - | expression tag |
| Ala -1 | - | expression tag |
| Ser 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 41603.2 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 1201.4 | |
| All* | Total formula weight | 42804.6 |
