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Ligand · CL9

CL9 · 2-chloro-2'-deoxyadenosine

CL9, 2-chloro-2'-deoxyadenosine (C10 H12 Cl N5 O3, 285.7 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
CL9
Formula
C10 H12 Cl N5 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

CL9 in 4 structures; the first of them:

  • 2ZI9 · C4S-E247A dCK variant of dCK in complex with cladribine+ADP · CL9 A401 · binds ILE30, GLU53, VAL55, TRP58, LEU82, MET85, TYR86, PHE96 and 11 more
  • 2ZIA · C4S dCK variant of dCK in complex with cladribine+UDP · CL9 A401 · binds ILE30, GLU53, VAL55, TRP58, LEU82, MET85, TYR86, PHE96 and 10 more
  • 2ZI9 · C4S-E247A dck variant of dck in complex with CLADRIBINE+ADP · CL9 A401 · binds ILE30, GLU53, VAL55, TRP58, LEU82, MET85, TYR86, PHE96 and 11 more
  • 2ZIA · C4S dck variant of dck in complex with CLADRIBINE+UDP · CL9 A401 · binds ILE30, GLU53, VAL55, TRP58, LEU82, MET85, TYR86, PHE96 and 10 more

Residues it binds most

ARG 8, GLU 8, LEU 8, PHE 8, TYR 8, ASP 8, GLN 8, ILE 8, MET 8, TRP 8 (residue and the binding sites it lines).

Found with

  • ADP · Adenosine-5'-diphosphate
  • UDP · Uridine-5'-diphosphate

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