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Ligand · 35Z

35Z · 2-[2-(3-methoxyphenyl)pyrimidin-4-yl]-1'-prop-2-enoyl-spiro[5,6-dihydro-1~{H}-pyrrolo[3,2-c]pyridine-7,4'-piperidine]-4-one

35Z, 2-[2-(3-methoxyphenyl)pyrimidin-4-yl]-1'-prop-2-enoyl-spiro[5,6-dihydro-1~{H}-pyrrolo[3,2-c]pyridine-7,4'-piperidine]-4-one (C25 H25 N5 O3, 443.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
35Z
Formula
C25 H25 N5 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

35Z in 2 structures; the first of them:

  • 7OXB · Crystal structure of EGFR double mutant (T790M/L858R) in complex with compound 6. · 35Z A1101 · binds LEU718, PHE723, VAL726, LYS728, ALA743, LYS745, GLU762, MET790 and 12 more
  • 7OXB · Crystal structure of EGFR double mutant (T790M/L858R) in complex with compound 6. · 35Z A1101 · binds LEU718, PHE723, LYS728, ALA743, LYS745, MET790, GLN791, LEU792 and 10 more

Residues it binds most

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

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