Ligand · 4YG
4YG · (1R,2S,5S)-N-{(1S,2S)-1-(1,3-benzothiazol-2-yl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-3-[N-(methanesulfonyl)-L-valyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide
4YG, (1R,2S,5S)-N-{(1S,2S)-1-(1,3-benzothiazol-2-yl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-3-[N-(methanesulfonyl)-L-valyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide (C28 H39 N5 O6 S2, 605.8 g/mol), in the MolNFT…
- Component
- 4YG
- Formula
- C28 H39 N5 O6 S2
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
4YG in 2 structures; the first of them:
- 7RFU · Structure of SARS-CoV-2 main protease in complex with a covalent inhibitor · 4YG A401 · binds THR25, LEU27, HIS41, CYS44, SER46, MET49, TYR54, PHE140 and 16 more
- 7RFU · Structure of SARS-cov-2 main protease in complex with a covalent inhibitor · 4YG A401 · binds THR25, LEU27, HIS41, CYS44, SER46, MET49, TYR54, PHE140 and 16 more
Residues it binds most
HIS 2, LEU 2, CYS 2, MET 2, SER 2, THR 2, ARG 2, ASN 2, ASP 2, GLN 2 (residue and the binding sites it lines).
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