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Ligand · E4U

E4U · [(1~{R})-1-[[(2~{S})-2-[[2,5-bis(chloranyl) phenyl]carbonylamino]-3-(1~{H}-indol-3-yl) propanoyl]amino]-3-methyl-butyl]boronic acid

E4U, [(1~{R})-1-[[(2~{S})-2-[[2,5-bis(chloranyl) phenyl]carbonylamino]-3-(1~{H}-indol-3-yl) propanoyl]amino]-3-methyl-butyl]boronic acid (C23 H26 B Cl2 N3 O4, 490.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
E4U
Formula
C23 H26 B Cl2 N3 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

E4U in 2 structures; the first of them:

  • 6L3X · Discovery of novel peptidomimetic boronate ClpP inhibitors with noncanonical enzyme… · E4U A201 · binds PRO67, GLY68, GLY69, SER70, VAL71, SER98, MET99, HIS123 and 7 more
  • 6L3X · Discovery of novel peptidomimetic boronate clpp inhibitors with noncanonical enzyme… · E4U A201 · binds GLY68, GLY69, SER70, VAL71, SER98, MET99, HIS123, GLN124 and 5 more

Residues it binds most

GLY 28, SER 28, LEU 28, PRO 28, GLN 28, HIS 28, MET 28, VAL 28, ILE 27, THR 5 (residue and the binding sites it lines).

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