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Ligand · UC9

UC9 · 4-{6-[(2S)-4-(2,4-diamino-6-ethylpyrimidin-5-yl)but-3-yn-2-yl]-2H-1,3-benzodioxol-4-yl}benzoic acid

UC9, 4-{6-[(2S)-4-(2,4-diamino-6-ethylpyrimidin-5-yl)but-3-yn-2-yl]-2H-1,3-benzodioxol-4-yl}benzoic acid (C24 H22 N4 O4, 430.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
UC9
Formula
C24 H22 N4 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

UC9 in 2 structures; the first of them:

  • 5JG0 · Staphylococcus aureus Dihydrofolate Reductase complexed with beta-NADPH and UCP1191 · UC9 X201 · binds LEU5, VAL6, ALA7, LEU20, ASP27, LEU28, HIS30, VAL31 and 8 more
  • 5JG0 · Staphylococcus aureus dihydrofolate reductase complexed with beta- NADPH and UCP1191 · UC9 X201 · binds LEU5, VAL6, ALA7, LEU20, ASP27, LEU28, HIS30, VAL31 and 8 more

Residues it binds most

LEU 2, THR 2, VAL 2, ALA 2, ARG 2, ASP 2, HIS 2, ILE 2, LYS 2, PHE 2 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate

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