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Ligand · HU8

HU8 · ~{N}-~{tert}-butyl-2-[4-chloranyl-2-[5-(3-chloranyl-4-fluoranyl-phenyl)-2-cyclohexyl-4-(1~{H}-1,2,3,4-tetrazol-5-yl)imidazol-1-yl]phenyl]ethanamide

HU8, ~{N}-~{tert}-butyl-2-[4-chloranyl-2-[5-(3-chloranyl-4-fluoranyl-phenyl)-2-cyclohexyl-4-(1~{H}-1,2,3,4-tetrazol-5-yl)imidazol-1-yl]phenyl]ethanamide (C28 H30 Cl2 F N7 O, 570.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
HU8
Formula
C28 H30 Cl2 F N7 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

HU8 in 2 structures; the first of them:

  • 6Q9O · HDM2 (17-111, WILDTYPE) COMPLEXED WITH COMPOUND 10 AT 1.21A; Structural states of Hdm2… · HU8 A201 · binds ILE19, LEU54, PHE55, LEU57, GLY58, GLN59, ILE61, MET62 and 13 more
  • 6Q9O · HDM2 (17-111, wildtype) complexed with compound 10 at 1.21A; structural states of HDM2… · HU8 A201 · binds LEU54, PHE55, GLY58, GLN59, ILE61, MET62, TYR67, GLN72 and 8 more

Residues it binds most

GLN 4, ILE 4, PHE 4, LEU 4, TYR 4, VAL 4, GLY 4, HIS 4, LYS 4, MET 4 (residue and the binding sites it lines).

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