GL1X · GenesisL1 explorer

Ligand · UN8

UN8 · N-(4-{[3-butyl-1-(2-fluorobenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}phenyl)-1-methyl-1H-imidazole-4-sulfonamide

UN8, N-(4-{[3-butyl-1-(2-fluorobenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}phenyl)-1-methyl-1H-imidazole-4-sulfonamide (C27 H28 F N7 O4 S, 565.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
UN8
Formula
C27 H28 F N7 O4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

UN8 in 2 structures; the first of them:

  • 2GMV · PEPCK complex with a GTP-competitive inhibitor · UN8 A703 · binds ALA287, CYS288, GLY289, ASN292, LEU293, MET296, LYS342, THR343 and 10 more
  • 2GMV · Pepck complex with a GTP-competitive inhibitor · UN8 A703 · binds ALA287, CYS288, GLY289, ASN292, LEU293, MET296, LYS342, THR343 and 10 more

Residues it binds most

GLY 2, PHE 2, ASN 2, TRP 2, ALA 2, ARG 2, CYS 2, LEU 2, LYS 2, MET 2 (residue and the binding sites it lines).

Found with

  • PEP · Phosphoenolpyruvate
  • MN · Manganese (II) ion

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