NNA · (1R,2S,5S)-3-[N-({1-[(tert-butylsulfonyl) methyl]cyclohexyl}carbamoyl)-3-methyl-L-valyl]-N-{(1S)-1-[(1R)-2-(cyclopropylamino)-1-hydroxy-2-oxoethyl]pentyl}-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide

Binding sites

NNA in 4 structures; the first of them:

• 7JYC · Crystal Structure of SARS-CoV-2 Main Protease (3CLpro/Mpro) in Complex with Covalent… · NNA A401 · binds THR25, THR26, LEU27, HIS41, MET49, TYR54, PHE140, LEU141 and 18 more
• 6XQT · Room-temperature X-ray crystal structure of SARS-cov-2 main protease in complex with… · NNA A401 · binds THR25, THR26, HIS41, MET49, TYR54, PHE140, LEU141, ASN142 and 17 more
• 7D1O · Crystal structure of SARS-cov-2 main protease with narlaprevir · NNA A401 · binds THR25, THR26, HIS41, MET49, TYR54, PHE140, LEU141, ASN142 and 15 more
• 7JYC · Crystal structure of SARS-cov-2 main protease (3CLPRO/MPRO) in complex with covalent… · NNA A401 · binds THR25, THR26, HIS41, MET49, TYR54, PHE140, LEU141, ASN142 and 15 more

Residues it binds most

THR 5, HIS 5, LEU 5, GLN 5, MET 5, PHE 5, ALA 5, ARG 5, ASN 5, ASP 5 (residue and the binding sites it lines).

Found with

• NA · Sodium ion
• DMS · Dimethyl sulfoxide