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Ligand · 4XU

4XU · 6-chloro-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-methyl-2-[3-(quinolin-2-yl)propoxy]pyrimidin-4-amine

4XU, 6-chloro-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-methyl-2-[3-(quinolin-2-yl)propoxy]pyrimidin-4-amine (C23 H24 Cl N5 O S, 454.0 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site…

Component
4XU
Formula
C23 H24 Cl N5 O S
Class
ligand
Structures
1
PDB entries
1

Binding sites

4XU in 1 structure; the first of them:

  • 5C2H · PDE10 complexed with 6-chloro-N-[(2,4-dimethylthiazol-5-YL)METHYL]-5… · 4XU B803 · binds TYR514, HIS515, LEU665, SER667, VAL668, ILE682, TYR683, GLU685 and 9 more

Residues it binds most

GLU 1, PHE 1, TYR 1, VAL 1, GLN 1, GLY 1, HIS 1, ILE 1, LEU 1, LYS 1 (residue and the binding sites it lines).

Found with

  • 4PX · 3-(1-hydroxy-2-methylpropan-2-yl)-5-phenyl-3,5-dihydro-1H-imidazo[4,5-c][1,8]naphthyridine-2,4-dione
  • MG · Magnesium ion
  • ZN · Zinc ion

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