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Ligand · 244

244 · [5-hydroxy-2-(4-hydroxyphenyl)-1-benzofuran-7-yl]acetonitrile

244, [5-hydroxy-2-(4-hydroxyphenyl)-1-benzofuran-7-yl]acetonitrile (C16 H11 N O3, 265.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…

Component
244
Formula
C16 H11 N O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

244 in 4 structures; the first of them:

  • 1X78 · Crystal structure of estrogen receptor beta complexed with way-244 · 244 A201 · binds MET295, LEU298, LEU301, ALA302, GLU305, MET336, LEU339, MET340 and 11 more
  • 1X7E · Crystal structure of estrogen receptor alpha complexed with way-244 · 244 A201 · binds MET343, LEU346, LEU349, ALA350, GLU353, LEU387, LEU391, ARG394 and 9 more
  • 1X78 · Crystal structure of estrogen receptor beta complexed with way-244 · 244 A201 · binds MET295, LEU298, LEU301, ALA302, GLU305, MET336, LEU339, MET340 and 11 more
  • 1X7E · Crystal structure of estrogen receptor alpha complexed with way-244 · 244 A201 · binds MET343, LEU346, LEU349, ALA350, GLU353, LEU387, LEU391, ARG394 and 9 more

Residues it binds most

LEU 8, MET 8, PHE 8, ILE 8, ALA 8, ARG 8, GLU 8, GLY 8, HIS 8 (residue and the binding sites it lines).

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