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Ligand · QGL

QGL · 2-[(2~{S})-2-ethylhexoxy]carbonylbenzoic acid

QGL, 2-[(2~{S})-2-ethylhexoxy]carbonylbenzoic acid (C16 H22 O4, 278.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
QGL
Formula
C16 H22 O4
Class
ligand
Structures
2
PDB entries
2

Binding sites

QGL in 2 structures; the first of them:

  • 8BF2 · Human PPARgamma in complex with MEHP bound to the AF-2 and omega sub-pockets · QGL A501 · binds PHE282, CYS285, GLN286, ARG288, SER289, ALA292, HIS323, ILE326 and 9 more
  • 8W98 · ESTS1 phthalate ester degrading esterase from Sulfobacillus acidophilus in complex with… · QGL A401 · binds LEU37, GLN40, MET41

Residues it binds most

LEU 4, ILE 3, MET 4, PHE 3, SER 3, ARG 3, CYS 3, GLN 2, GLU 1, GLY 2 (residue and the binding sites it lines).

Found with

  • 2EH · (2S)-2-ethylhexan-1-ol
  • ACE · Acetyl group

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