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Ligand · AVE

AVE · 4-[3-(2-Chloro-4,5-difluoro-benzoyl)ureido]-3-trifluoromethoxybenzoic acid

AVE, 4-[3-(2-Chloro-4,5-difluoro-benzoyl)ureido]-3-trifluoromethoxybenzoic acid (C16 H8 Cl F5 N2 O5, 438.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
AVE
Formula
C16 H8 Cl F5 N2 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

AVE in 2 structures; the first of them:

  • 3CEH · Human liver glycogen phosphorylase (tense state) in complex with the allosteric inhibitor… · AVE A833 · binds TRP67, ILE68, GLN71, GLN72, TYR75, LYS191, ARG193, ASP227 and 6 more
  • 3CEH · Human liver glycogen phosphorylase (tense state) in complex with the allosteric inhibitor… · AVE A833 · binds TRP67, ILE68, GLN71, GLN72, TYR75, LYS191, ARG193, ASP227 and 6 more

Residues it binds most

ASP 4, GLN 4, LYS 4, VAL 4, ARG 4, ASN 4, ILE 4, LEU 4, TRP 4, TYR 4 (residue and the binding sites it lines).

Found with

  • NBG · N-acetyl-beta-D-glucopyranosylamine
  • PLP · Pyridoxal-5'-phosphate
  • PO4 · Phosphate ion
  • MES · 2-(N-morpholino)-ethanesulfonic acid

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