PDBsum entry 7l8j

Hydrolase/inhibitor

PDB id: 7l8j

Contents

Protein chain

305 a.a.

Ligands

AG7

Waters ×44

PDB id:

7l8j

Name:

Hydrolase/inhibitor

Title:

Sars-cov-2 main protease (mpro) in complex with rupintrivir (p21212)

Structure:

3c-like proteinase. Chain: a. Synonym: sars-cov-2 main protease. Engineered: yes

Source:

Severe acute respiratory syndrome coronavirus 2. 2019-ncov, sars-cov-2, covid-19 virus. Organism_taxid: 2697049. Gene: rep, 1a-1b. Expressed in: escherichia coli. Expression_system_taxid: 562

Resolution:

2.45Å R-factor: 0.226 R-free: 0.281

Authors:

G.J.Lockbaum,M.Henes,J.M.Lee,J.Timm,E.A.Nalivaika,N.K.Yilmaz, P.R.Thompson,C.A.Schiffer

Key ref:

G.J.Lockbaum et al. Pan-3c protease inhibitor rupintrivir binds sars-Cov- Protease in a unique binding mode.. Biochemistry, . PubMed id: 34506130

Date:

31-Dec-20 Release date: 22-Sep-21

Protein chain

P0DTD1  (R1AB_SARS2) -

Enzyme reactions

• Enzyme class: E.C.3.4.22.69 - Sars coronavirus main proteinase.