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Ligand · KJ8

KJ8 · N-[3-(4-{[(1S)-2-hydroxy-1-phenylethyl]amino}-6-phenylfuro[2,3-d]pyrimidin-5-yl)phenyl]-N~3~,N~3~-dimethyl-beta-alaninamide

KJ8, N-[3-(4-{[(1S)-2-hydroxy-1-phenylethyl]amino}-6-phenylfuro[2,3-d]pyrimidin-5-yl)phenyl]-N~3~,N~3~-dimethyl-beta-alaninamide (C31 H31 N5 O3, 521.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
KJ8
Formula
C31 H31 N5 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

KJ8 in 2 structures; the first of them:

  • 4JQ8 · Crystal structure of EGFR kinase domain in complex with compound 4b · KJ8 A1001 · binds LEU694, GLY695, PHE699, VAL702, ALA719, ILE720, LYS721, MET742 and 12 more
  • 4JQ8 · Crystal structure of EGFR kinase domain in complex with compound 4B · KJ8 A1001 · binds LEU694, GLY695, PHE699, VAL702, ALA719, ILE720, LYS721, MET742 and 12 more

Residues it binds most

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

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