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Ligand · ZJ1

ZJ1 · (2R)-2-[(4-tert-butylphenyl)(ethanesulfonyl)amino]-N-cyclohexyl-2-(pyridin-3-yl)acetamide

ZJ1, (2R)-2-[(4-tert-butylphenyl)(ethanesulfonyl)amino]-N-cyclohexyl-2-(pyridin-3-yl)acetamide (C25 H35 N3 O3 S, 457.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
ZJ1
Formula
C25 H35 N3 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

ZJ1 in 2 structures; the first of them:

  • 7MLG · Crystal Structure of SARS-CoV-2 Main Protease (3CLpro/Mpro) Covalently Bound to Compound… · ZJ1 A401 · binds HIS41, CYS44, MET49, TYR54, PHE140, LEU141, ASN142, GLY143 and 11 more
  • 7MLG · Crystal structure of SARS-cov-2 main protease (3CLPRO/MPRO) covalently bound to compound… · ZJ1 A401 · binds HIS41, CYS44, MET49, TYR54, PHE140, LEU141, ASN142, GLY143 and 11 more

Residues it binds most

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

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