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Ligand · VHP

VHP · N-[(benzyloxy)carbonyl]-O-tert-butyl-L-threonyl-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-leucinamide

VHP, N-[(benzyloxy)carbonyl]-O-tert-butyl-L-threonyl-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-leucinamide (C29 H46 N4 O7, 562.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
VHP
Formula
C29 H46 N4 O7
Class
ligand
Structures
2
PDB entries
1

Binding sites

VHP in 2 structures; the first of them:

  • 7JQ3 · Structure of the SARS-CoV-2 main protease in complex with inhibitor MPI6 · VHP A401 · binds HIS41, TYR54, PHE140, LEU141, ASN142, GLY143, SER144, CYS145 and 13 more
  • 7JQ3 · Structure of the SARS-cov-2 main protease in complex with inhibitor MPI6 · VHP A401 · binds HIS41, TYR54, PHE140, LEU141, ASN142, GLY143, SER144, CYS145 and 13 more

Residues it binds most

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

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