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Ligand · 2XM

2XM · 2,2'-((4-(4-(((4,6-diaminopyrimidin-2-yl)thio)methyl)-5-propylthiazol-2-yl)-1,2-phenylene)bis(oxy))bis(ethan-1-ol)

2XM, 2,2'-((4-(4-(((4,6-diaminopyrimidin-2-yl)thio)methyl)-5-propylthiazol-2-yl)-1,2-phenylene)bis(oxy))bis(ethan-1-ol) (C21 H27 N5 O4 S2, 477.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
2XM
Formula
C21 H27 N5 O4 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

2XM in 2 structures; the first of them:

  • 4Q1C · Human dCK C4S-S74E mutant in complex with UDP and the inhibitor 8… · 2XM A301 · binds ILE30, GLU53, VAL55, LEU82, MET85, TYR86, GLU87, PRO89 and 12 more
  • 4Q1C · Human dck C4S-S74E mutant in complex with udp and the inhibitor 8 {2… · 2XM A301 · binds ILE30, GLU53, VAL55, LEU82, MET85, TYR86, GLU87, PRO89 and 12 more

Residues it binds most

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

Found with

  • UDP · Uridine-5'-diphosphate

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