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Ligand · MWW

MWW · 4-[1-[4-[4-(2-phenylethyl)-1,3-thiazol-2-yl]-3-(2-piperidin-4-ylethoxy)phenyl]-1,2,3-triazol-4-yl]butan-1-amine

MWW, 4-[1-[4-[4-(2-phenylethyl)-1,3-thiazol-2-yl]-3-(2-piperidin-4-ylethoxy)phenyl]-1,2,3-triazol-4-yl]butan-1-amine (C30 H38 N6 O S, 530.7 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site…

Component
MWW
Formula
C30 H38 N6 O S
Class
ligand
Structures
1
PDB entries
1

Binding sites

MWW in 1 structure; the first of them:

  • 6T97 · Trypanothione reductase from leismania infantum in complex with TRL190 · MWW A510 · binds LEU17, GLU18, TRP21, SER105, ILE106, SER109, TYR110, MET113 and 3 more

Residues it binds most

GLU 1, SER 1, ASP 1, ILE 1, LEU 1, MET 1, THR 1, TRP 1, TYR 1 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • SO4 · Sulfate ion
  • GOL · Glycerol

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