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Ligand · CY6

CY6 · N-((3S,6R)-6-((S,E)-4-ethoxycarbonyl-1-((S)-2-oxopyrrolidin-3-yl)but-3-en-2-ylcarbamoyl)-2,9-dimethyl-4-oxodec-8-en-3-yl)-5-methylisoxazole-3-carboxamide

CY6, N-((3S,6R)-6-((S,E)-4-ethoxycarbonyl-1-((S)-2-oxopyrrolidin-3-yl)but-3-en-2-ylcarbamoyl)-2,9-dimethyl-4-oxodec-8-en-3-yl)-5-methylisoxazole-3-carboxamide (C29 H42 N4 O7, 558.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
CY6
Formula
C29 H42 N4 O7
Class
ligand
Structures
2
PDB entries
1

Binding sites

CY6 in 2 structures; the first of them:

  • 2ALV · X-ray structural analysis of SARS coronavirus 3CL proteinase in complex with designed… · CY6 A1145 · binds THR26, LEU27, HIS41, CYS44, MET49, TYR54, PHE140, LEU141 and 17 more
  • 2ALV · X-ray structural analysis of SARS coronavirus 3CL proteinase in complex with designed… · CY6 A1145 · binds THR26, LEU27, HIS41, CYS44, MET49, TYR54, PHE140, LEU141 and 17 more

Residues it binds most

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

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