GL1X · GenesisL1 explorer

Ligand · 458

458 · 4-[(1S,2S,5S)-5-(hydroxymethyl)-8-methyl-3-oxabicyclo[3.3.1]non-7-en-2-yl]phenol

458, 4-[(1S,2S,5S)-5-(hydroxymethyl)-8-methyl-3-oxabicyclo[3.3.1]non-7-en-2-yl]phenol (C16 H20 O3, 260.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
458
Formula
C16 H20 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

458 in 2 structures; the first of them:

  • 2B1V · Human estrogen receptor alpha ligand-binding domain in complex with OBCP-1M and a… · 458 A201 · binds MET343, LEU346, ALA350, GLU353, TRP383, LEU384, LEU387, MET388 and 8 more
  • 2B1V · Human estrogen receptor alpha ligand-binding domain in complex with obcp-1M and a… · 458 A201 · binds MET343, LEU346, ALA350, GLU353, TRP383, LEU384, LEU387, MET388 and 8 more

Residues it binds most

LEU 4, MET 4, ALA 4, ARG 4, GLU 4, GLY 4, HIS 4, ILE 4, PHE 4, TRP 4 (residue and the binding sites it lines).

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