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Ligand · 2Y1

2Y1 · (R)-2-((1-(2-(3-(2-fluoroethoxy)-4-methoxyphenyl)-5-propylthiazol-4-yl)ethyl)thio)pyrimidine-4,6-diamine

2Y1, (R)-2-((1-(2-(3-(2-fluoroethoxy)-4-methoxyphenyl)-5-propylthiazol-4-yl)ethyl)thio)pyrimidine-4,6-diamine (C21 H26 F N5 O2 S2, 463.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
2Y1
Formula
C21 H26 F N5 O2 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

2Y1 in 2 structures; the first of them:

  • 4Q1D · Human dCK C4S-S74E mutant in complex with UDP and the inhibitor 9… · 2Y1 A301 · binds ILE30, GLU53, VAL55, LEU82, MET85, TYR86, PRO89, PHE96 and 13 more
  • 4Q1D · Human dck C4S-S74E mutant in complex with udp and the inhibitor 9 {2… · 2Y1 A301 · binds ILE30, GLU53, VAL55, LEU82, MET85, TYR86, PRO89, PHE96 and 13 more

Residues it binds most

LEU 4, ARG 4, PHE 4, SER 4, TYR 4, GLU 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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