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Ligand · 1QC

1QC · N-{2-[5-(4-{[(4,6-diaminopyrimidin-2-yl)sulfanyl]methyl}-5-propyl-1,3-thiazol-2-yl)-2-methoxyphenoxy]ethyl}methanesulfonamide

1QC, N-{2-[5-(4-{[(4,6-diaminopyrimidin-2-yl)sulfanyl]methyl}-5-propyl-1,3-thiazol-2-yl)-2-methoxyphenoxy]ethyl}methanesulfonamide (C21 H28 N6 O4 S3, 524.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
1QC
Formula
C21 H28 N6 O4 S3
Class
ligand
Structures
2
PDB entries
1

Binding sites

1QC in 2 structures; the first of them:

  • 4KCG · Human dCK C4S-S74E mutant in complex with UDP and the DI-39 inhibitor · 1QC A301 · binds ILE30, GLU53, VAL55, LEU82, MET85, TYR86, PRO89, PHE96 and 14 more
  • 4KCG · Human dck C4S-S74E mutant in complex with udp and the di-39 inhibitor · 1QC A301 · binds ILE30, GLU53, VAL55, LEU82, MET85, TYR86, PRO89, PHE96 and 14 more

Residues it binds most

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

Found with

  • UDP · Uridine-5'-diphosphate

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