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Ligand · 18V

18V · 2-[({2-[3-(2-fluoroethoxy)-4-methoxyphenyl]-5-propyl-1,3-thiazol-4-yl}methyl)sulfanyl]pyrimidine-4,6-diamine

18V, 2-[({2-[3-(2-fluoroethoxy)-4-methoxyphenyl]-5-propyl-1,3-thiazol-4-yl}methyl)sulfanyl]pyrimidine-4,6-diamine (C20 H24 F N5 O2 S2, 449.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
18V
Formula
C20 H24 F N5 O2 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

18V in 2 structures; the first of them:

  • 4JLN · Human dCK C4S-S74E mutant in complex with UDP and the F2.4.1 inhibitor… · 18V A301 · binds ILE30, GLU53, VAL55, SER59, LEU82, MET85, TYR86, PRO89 and 12 more
  • 4JLN · Human dck C4S-S74E mutant in complex with udp and the F2.4.1 inhibitor… · 18V A301 · binds ILE30, GLU53, VAL55, SER59, LEU82, MET85, TYR86, PRO89 and 12 more

Residues it binds most

SER 4, ARG 4, GLU 4, LEU 4, PHE 4, TYR 4, ILE 4, ALA 4, ASP 4, GLN 4 (residue and the binding sites it lines).

Found with

  • UDP · Uridine-5'-diphosphate

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