GL1X · GenesisL1 explorer

Ligand · 80U

80U · 1-[(3R)-3-[4-azanyl-3-[3-chloranyl-4-[(1-methylimidazol-2-yl)methoxy]phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one

80U, 1-[(3R)-3-[4-azanyl-3-[3-chloranyl-4-[(1-methylimidazol-2-yl)methoxy]phenyl]pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one (C24 H25 Cl N8 O2, 493.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
80U
Formula
C24 H25 Cl N8 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

80U in 2 structures; the first of them:

  • 5GNK · Crystal structure of EGFR 696-988 T790M in complex with LXX-6-34 · 80U A1001 · binds LEU718, GLY719, VAL726, ALA743, ILE744, LYS745, MET766, CYS775 and 15 more
  • 5GNK · Crystal structure of EGFR 696-988 T790M in complex with lxx-6-34 · 80U A1001 · binds LEU718, GLY719, VAL726, ALA743, ILE744, LYS745, MET766, CYS775 and 15 more

Residues it binds most

LEU 2, MET 2, ARG 2, ASP 2, CYS 2, ILE 2, ALA 2, GLN 2, GLY 2, LYS 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • NO3 · Nitrate ion
  • EDO · 1,2-ethanediol

GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.