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Ligand · 4HV

4HV · N-[(2R)-1-(3-cyanophenyl)-3-hydroxypropan-2-yl]-5-(3,4-dimethoxyphenyl)furan-3-carboxamide

4HV, N-[(2R)-1-(3-cyanophenyl)-3-hydroxypropan-2-yl]-5-(3,4-dimethoxyphenyl)furan-3-carboxamide (C23 H22 N2 O5, 406.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
4HV
Formula
C23 H22 N2 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

4HV in 2 structures; the first of them:

  • 4HVA · Mechanistic and Structural Understanding of Uncompetitive Inhibitors of Caspase-6 · 4HV A401 · binds LEU61, PRO62, HIS121, GLY122, GLU123, TYR128, HIS168, TYR217 and 10 more
  • 4HVA · Mechanistic and structural understanding of uncompetitive inhibitors of caspase-6 · 4HV A401 · binds LEU61, PRO62, HIS121, GLY122, GLU123, TYR128, HIS168, TYR217 and 10 more

Residues it binds most

HIS 4, GLU 4, TYR 4, VAL 4, 4H0 4, ALA 4, ASP 4, CYS 4, GLY 4, ILE 4 (residue and the binding sites it lines).

Found with

  • PHQ · benzyl chlorocarbonate

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