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Ligand · X9T

X9T · (9M)-9-{5-chloro-6-[(3,3-dimethyl-2,3-dihydro-1-benzofuran-4-yl)oxy]-4-methylpyridin-3-yl}-2-methyl-7,9-dihydro-8H-purin-8-one

X9T, (9M)-9-{5-chloro-6-[(3,3-dimethyl-2,3-dihydro-1-benzofuran-4-yl)oxy]-4-methylpyridin-3-yl}-2-methyl-7,9-dihydro-8H-purin-8-one (C22 H20 Cl N5 O3, 437.9 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry).…

Component
X9T
Formula
C22 H20 Cl N5 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

X9T in 1 structure; the first of them:

  • 8F1C · Voltage-gated potassium channel Kv3.1 with novel positive modulator… · X9T A602 · binds MET362, TYR364, TYR365, ALA366, ARG368, ILE369, GLY370, ALA371 and 5 more

Residues it binds most

ALA 4, PHE 4, TYR 4, ARG 4, GLN 4, GLY 4, ILE 4, MET 4, PRO 4, VAL 4 (residue and the binding sites it lines).

Found with

  • POV · (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate
  • K · Potassium ion
  • ZN · Zinc ion

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