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Ligand · JEX

JEX · 5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

JEX, 5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole (C20 H10 F6 N2 O S, 440.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
JEX
Formula
C20 H10 F6 N2 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

JEX in 2 structures; the first of them:

  • 7EW7 · Cryo-EM structure of SEW2871-bound Sphingosine-1-phosphate receptor 1 in complex with Gi… · JEX D401 · binds ASN101, GLU121, MET124, PHE125, LEU128, SER129, VAL132, LEU195 and 6 more
  • 7EW7 · Cryo-EM structure of SEW2871-bound sphingosine-1-phosphate receptor 1 in complex with gi… · JEX D401 · binds ASN101, GLU121, MET124, PHE125, LEU128, SER129, VAL132, LEU195 and 6 more

Residues it binds most

LEU 2, PHE 2, ASN 2, CYS 2, GLU 2, MET 2, SER 2, TRP 2, VAL 2 (residue and the binding sites it lines).

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