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Ligand · A5G

A5G · 1-[(4S)-5-(2,4-difluorophenyl)imidazo[2,1-B][1,3, 4]thiadiazol-2-yl]-4-methylpiperidin-4-amine

A5G, 1-[(4S)-5-(2,4-difluorophenyl)imidazo[2,1-B][1,3, 4]thiadiazol-2-yl]-4-methylpiperidin-4-amine (C16 H17 F2 N5 S, 349.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
A5G
Formula
C16 H17 F2 N5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

A5G in 2 structures; the first of them:

  • 7SQM · Discovery and Preclinical Pharmacology of INE963, A Potent and Fast-Acting Blood-Stage… · A5G A801 · binds ILE490, GLY491, VAL498, ALA509, LYS511, GLU535, ILE557, PHE605 and 9 more
  • 7SQM · Discovery and preclinical pharmacology of INE963, a potent and fast- acting blood-stage… · A5G A801 · binds ILE490, ALA509, LYS511, ILE557, PHE605, GLU606, PHE607, GLY608 and 6 more

Residues it binds most

GLY 2, ILE 2, ASP 2, PHE 2, GLU 2, ALA 2, LEU 2, LYS 2, VAL 1 (residue and the binding sites it lines).

Found with

  • GOL · Glycerol

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