4GHT

Crystal structure of EV71 3C proteinase in complex with AG7088

Summary for 4GHT

• Entry DOI: 10.2210/pdb4ght/pdb
• Related: 4GHQ 4GHV 4GHX 4GHY 4GHZ
• Descriptor: 3C proteinase, 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 (3 entities in total)
• Functional Keywords: hydrolase, cysteine proteinase, inhibitor, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Human enterovirus 71
• Cellular location: Picornain 3C: Host cytoplasm (By similarity). Protein 3B: Virion (By similarity): A9XG43
• Total number of polymer chains: 2
• Total formula weight: 43984.32

Authors

Chen, C.,Wu, C.,Cai, Q.,Li, N.,Peng, X.,Cai, Y.,Yin, K.,Chen, X.,Wang, X.,Zhang, R.,Liu, L.,Chen, S.,Li, J.,Lin, T. (deposition date: 2012-08-08, release date: 2013-06-26, Last modification date: 2023-11-08)

• Primary citation: Wu, C.,Cai, Q.,Chen, C.,Li, N.,Peng, X.,Cai, Y.,Yin, K.,Chen, X.,Wang, X.,Zhang, R.,Liu, L.,Chen, S.,Li, J.,Lin, T.; Structures of Enterovirus 71 3C proteinase (strain E2004104-TW-CDC) and its complex with rupintrivir; Acta Crystallogr.,Sect.D, 69:866-871, 2013; PubMed: 23633597; DOI: 10.1107/S0907444913002862

Experimental method

X-RAY DIFFRACTION (1.96 Å)