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Ligand · D8G

D8G · 6-(2-fluorobenzyl)-2,4-dimethyl-4,6-dihydro-5H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-5-one

D8G, 6-(2-fluorobenzyl)-2,4-dimethyl-4,6-dihydro-5H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-5-one (C17 H14 F N3 O S, 327.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
D8G
Formula
C17 H14 F N3 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

D8G in 2 structures; the first of them:

  • 3H6O · Activator-Bound Structure of Human Pyruvate Kinase M2 · D8G B550 · binds PHE26, LEU353, ASP354, TYR390, GLN393, LEU394, GLU397, PHE26 and 5 more
  • 3H6O · Activator-bound structure of human pyruvate kinase M2 · D8G B550 · binds PHE26, LEU353, ASP354, TYR390, GLN393, LEU394, GLU397, PHE26 and 5 more

Residues it binds most

LEU 4, GLN 4, PHE 4, TYR 4, GLU 4, MET 4, ASP 2 (residue and the binding sites it lines).

Found with

  • FBP · 1,6-di-O-phosphono-beta-D-fructofuranose
  • UNX · Unknown atom or ion

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