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Ligand · 4DG

4DG · 2-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl) methoxy]ethyl dihydrogen phosphate

4DG, 2-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl) methoxy]ethyl dihydrogen phosphate (C8 H12 N5 O6 P, 305.2 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
4DG
Formula
C8 H12 N5 O6 P
Class
ligand
Structures
2
PDB entries
1

Binding sites

4DG in 2 structures; the first of them:

  • 7B7V · Structure of NUDT15 in complex with Acyclovir monophosphate · 4DG A201 · binds GLY15, VAL16, ARG34, VAL38, GLN44, LEU45, PRO46, GLY47 and 8 more
  • 7B7V · Structure of NUDT15 in complex with acyclovir monophosphate · 4DG A201 · binds GLY15, ARG34, GLN44, LEU45, GLY47, GLY48, HIS49, TYR92 and 5 more

Residues it binds most

GLY 4, ARG 4, GLN 4, HIS 4, LEU 4, LYS 4, PHE 4, THR 4, TRP 4, TYR 4 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • CL · Chloride ion

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