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Ligand · QL5

QL5 · (2,5-dimethylphenyl) pyridine-4-carboxylate

QL5, (2,5-dimethylphenyl) pyridine-4-carboxylate (C14 H13 N O2, 227.3 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
QL5
Formula
C14 H13 N O2
Class
ligand
Structures
3
PDB entries
2

Binding sites

QL5 in 3 structures; the first of them:

  • 7BD8 · Notum Fragment 872 · QL5 A509 · binds TRP128, TYR129, ALA233, PHE268, LEU269, THR288, ILE291, PHE320 and 2 more
  • 6ZGY · Structure of human galactokinase 1 bound with 2-(4-chlorophenyl)-N… · QL5 A403 · binds LEU213, SER214, ASP215, LEU218, VAL220, LEU295, PHE303, LEU355
  • 7BD8 · Notum fragment 872 · QL5 A509 · binds TRP128, TYR129, ALA233, PHE268, LEU269, THR288, ILE291, PHE320 and 2 more

Residues it binds most

LEU 4, PHE 4, ALA 3, VAL 4, SER 2, ASP 2, ILE 2, THR 2, TRP 2, TYR 2 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • HFK · 2-(1,3-benzoxazol-2-ylamino)spiro[1,6,7,8-tetrahydroquinazoline-4,1'-cyclohexane]-5-one
  • GAL · beta-D-galactopyranose

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