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Ligand · BK5

BK5 · 3-(6-ethoxynaphthalen-2-yl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

BK5, 3-(6-ethoxynaphthalen-2-yl)-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine (C20 H21 N5 O, 347.4 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…

Component
BK5
Formula
C20 H21 N5 O
Class
ligand
Structures
4
PDB entries
2

Binding sites

BK5 in 4 structures; the first of them:

  • 3SXF · Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with… · BK5 A701 · binds LEU57, GLY58, GLY60, VAL65, ALA78, LYS80, LEU103, MET112 and 12 more
  • 3UQF · c-SRC kinase domain in complex with BKI RM-1-89 · BK5 A1 · binds LEU273, VAL281, ALA293, LYS295, PHE307, GLU310, ALA311, MET314 and 10 more
  • 3SXF · Calcium-dependent protein kinase 1 from toxoplasma gondii (TGCDPK1) in complex with… · BK5 A701 · binds LEU57, GLY58, GLY60, VAL65, ALA78, LYS80, LEU103, MET112 and 12 more
  • 3UQF · C-src kinase domain in complex with bki rm-1-89 · BK5 A1 · binds LEU273, VAL281, ALA293, LYS295, PHE307, GLU310, ALA311, MET314 and 10 more

Residues it binds most

LEU 6, GLY 6, VAL 6, ALA 6, MET 6, GLU 6, ASP 6, ILE 6, LYS 6, PHE 6 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol

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