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Ligand · AVT

AVT · 2-[9-fluoranyl-5-(4-methoxyphenyl)-3-methyl-1-oxidanylidene-pyrimido[4,5-c]quinolin-2-yl]ethanoic acid

AVT, 2-[9-fluoranyl-5-(4-methoxyphenyl)-3-methyl-1-oxidanylidene-pyrimido[4,5-c]quinolin-2-yl]ethanoic acid (C21 H16 F N3 O4, 393.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
AVT
Formula
C21 H16 F N3 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

AVT in 2 structures; the first of them:

  • 5OUK · Crystal structure of human AKR1B1 complexed with NADP+ and compound 41 · AVT A402 · binds TRP20, VAL47, TYR48, GLN49, TRP79, HIS110, TRP111, PHE121 and 6 more
  • 5OUK · Crystal structure of human AKR1B1 complexed with NADP+ and compound 41 · AVT A402 · binds TRP20, VAL47, TYR48, GLN49, TRP79, HIS110, TRP111, PHE121 and 6 more

Residues it binds most

TRP 2, LEU 2, PHE 2, CYS 2, GLN 2, HIS 2, SER 2, TYR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate

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