3TIT

Crystal structure of SARS coronavirus main protease complexed with an alpha, beta-unsaturated ethyl ester SG81

Summary for 3TIT

• Entry DOI: 10.2210/pdb3tit/pdb
• Related: 2h2z
• Descriptor: SARS coronavirus main protease, ETHYL (4R)-4-{[N-(TERT-BUTOXYCARBONYL)-L-PHENYLALANYL]AMINO}-5-[(3S)-2-OXOPYRROLIDIN-3-YL]PENTANOATE (3 entities in total)
• Functional Keywords: sars coronavirus main protease, protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: SARS coronavirus (SARS-CoV)
• Cellular location: Non-structural protein 3: Host membrane ; Multi-pass membrane protein . Non-structural protein 4: Host membrane ; Multi-pass membrane protein . Non-structural protein 6: Host membrane ; Multi-pass membrane protein . Non-structural protein 7: Host cytoplasm, host perinuclear region . Non-structural protein 8: Host cytoplasm, host perinuclear region . Non-structural protein 9: Host cytoplasm, host perinuclear region . Non-structural protein 10: Host cytoplasm, host perinuclear region : P0C6U8
• Total number of polymer chains: 1
• Total formula weight: 34352.22

Authors

Zhu, L.,Hilgenfeld, R. (deposition date: 2011-08-21, release date: 2012-08-22, Last modification date: 2024-10-16)

• Primary citation: Zhu, L.,Hilgenfeld, R.; Crystal structures of SARS-Cov main protease complexed with a series of unsaturated esters; To be Published,

Experimental method

X-RAY DIFFRACTION (1.99 Å)