4GHT
Crystal structure of EV71 3C proteinase in complex with AG7088
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 proteinase | polymer | 192 | 21391.5 | 2 | UniProt (A9XG43) Pfam (PF00548) In PDB | Human enterovirus 71 | |
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 | 194 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 183 (UniProt: A9XG43)
PDB | External Database | Details |
---|---|---|
Met 0 | - | expression tag |
Leu 184 | - | expression tag |
Glu 185 | - | expression tag |
His 186 | - | expression tag |
His 187 | - | expression tag |
His 188 | - | expression tag |
His 189 | - | expression tag |
His 190 | - | expression tag |
His 191 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 42783.0 | |
Non-Polymers* | Number of molecules | 2 |
Total formula weight | 1201.4 | |
All* | Total formula weight | 43984.3 |