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Ligand · ISG

ISG · N-{(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-N~2~-({[(1R,2R)-2-phenylcyclopropyl]methoxy}carbonyl)-L-leucinamide

ISG, N-{(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-N~2~-({[(1R,2R)-2-phenylcyclopropyl]methoxy}carbonyl)-L-leucinamide (C24 H33 N3 O5, 443.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
ISG
Formula
C24 H33 N3 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

ISG in 2 structures; the first of them:

  • 7TQ2 · Structure of SARS-CoV-2 3CL protease in complex with the cyclopropane based inhibitor 1c · ISG A401 · binds LEU27, HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144 and 12 more
  • 7TQ2 · Structure of SARS-cov-2 3CL protease in complex with the cyclopropane based inhibitor 1C · ISG A401 · binds LEU27, HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144 and 12 more

Residues it binds most

HIS 4, MET 4, LEU 4, ALA 4, ARG 4, ASN 4, ASP 4, CYS 4, GLN 4, GLU 4 (residue and the binding sites it lines).

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