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Ligand · G65

G65 · Masitinib

G65, Masitinib (C28 H30 N6 O S, 498.6 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
G65
Formula
C28 H30 N6 O S
Class
ligand
Structures
4
PDB entries
3

Binding sites

G65 in 4 structures; the first of them:

  • 5MQL · Crystal structure of dCK mutant C3S in complex with masitinib and UDP · G65 A302 · binds GLU53, VAL55, LEU82, MET85, TYR86, PRO89, GLU90, PHE96 and 8 more
  • 5MQL · Crystal structure of dck mutant C3S in complex with masitinib and udp · G65 A302 · binds GLU53, VAL55, LEU82, MET85, TYR86, PRO89, GLU90, PHE96 and 8 more
  • 7JU7 · The crystal structure of SARS-cov-2 main protease in complex with masitinib · G65 A401 · binds THR24, THR25, HIS41, CYS44, THR45, SER46, MET49, PHE140 and 8 more
  • 7TVX · The crystal structure of SARS-cov-2 omicron mpro (P132H) in complex with masitinib · G65 A401 · binds THR24, THR25, HIS41, CYS44, THR45, SER46, MET49, PHE140 and 10 more

Residues it binds most

GLU 4, CYS 4, HIS 2, MET 4, PHE 4, SER 4, THR 2, LEU 4, TYR 2, ASP 3 (residue and the binding sites it lines).

Found with

  • DCM · 2'-deoxycytidine-5'-monophosphate
  • UDP · Uridine-5'-diphosphate
  • MG · Magnesium ion
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol

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