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Ligand · QYD

QYD · N-(4-nitrophenyl)-2-phenyl-thiomorpholine-4-carboxamide

QYD, N-(4-nitrophenyl)-2-phenyl-thiomorpholine-4-carboxamide (C17 H17 N3 O3 S, 343.4 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, the residues it binds…

Component
QYD
Formula
C17 H17 N3 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

QYD in 2 structures; the first of them:

  • 5ALP · ligand complex structure of soluble epoxide hydrolase · QYD A1554 · binds PHE267, PRO268, ASP335, TRP336, THR360, ILE375, PHE381, TYR383 and 8 more
  • 5ALP · Ligand complex structure of soluble epoxide hydrolase · QYD A1554 · binds PHE267, PRO268, ASP335, TRP336, THR360, ILE375, PHE381, TYR383 and 8 more

Residues it binds most

LEU 2, PHE 2, TRP 2, TYR 2, ASP 2, GLN 2, HIS 2, ILE 2, MET 2, PRO 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • GOL · Glycerol
  • PEG · Di(hydroxyethyl)ether

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