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Ligand · WW8

WW8 · N-[(3S)-1-({6-chloro-3-[1-(4-chlorobenzyl)-4-phenyl-1H-imidazol-5-yl]-1H-indol-2-yl}carbonyl)pyrrolidin-3-yl]-N,N',N'-trimethylpropane-1,3-diamine

WW8, N-[(3S)-1-({6-chloro-3-[1-(4-chlorobenzyl)-4-phenyl-1H-imidazol-5-yl]-1H-indol-2-yl}carbonyl)pyrrolidin-3-yl]-N,N',N'-trimethylpropane-1,3-diamine (C35 H38 Cl2 N6 O, 629.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
WW8
Formula
C35 H38 Cl2 N6 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

WW8 in 2 structures; the first of them:

  • 3LBJ · Structure of human MDMX protein in complex with a small molecule inhibitor · WW8 E1 · binds MET53, HIS54, LEU56, GLY57, ILE60, MET61, TYR66, GLN71 and 5 more
  • 3LBJ · Structure of human mdmx protein in complex with a small molecule inhibitor · WW8 E1 · binds MET53, HIS54, LEU56, GLY57, ILE60, MET61, TYR66, GLN71 and 5 more

Residues it binds most

VAL 4, LEU 4, TYR 4, MET 2, ARG 2, ASP 2, GLN 2, GLY 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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