GL1X · GenesisL1 explorer

Ligand · YHJ

YHJ · Benzyl (1s,3ar,6as)-1-({(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}carbamoyl) hexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate

YHJ, Benzyl (1s,3ar,6as)-1-({(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}carbamoyl) hexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate (C23 H31 N3 O5, 429.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
YHJ
Formula
C23 H31 N3 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

YHJ in 2 structures; the first of them:

  • 7LYH · Crystal structure of the SARS-CoV-2 (COVID-19) main protease in complex with inhibitor… · YHJ A401 · binds HIS41, MET49, TYR54, PHE140, LEU141, ASN142, GLY143, SER144 and 13 more
  • 7LYH · Crystal structure of the SARS-cov-2 (COVID-19) main protease in complex with inhibitor… · YHJ A401 · binds HIS41, MET49, PHE140, LEU141, ASN142, GLY143, SER144, CYS145 and 10 more

Residues it binds most

HIS 2, MET 2, LEU 2, ARG 2, ASN 2, ASP 2, CYS 2, GLN 2, GLU 2, GLY 2 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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