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Ligand · RW4

RW4 · 3-(2-amino-1,3-benzothiazol-6-yl)-1-{[2-(4-methylpiperazin-1-yl)quinolin-3-yl]methyl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine

RW4, 3-(2-amino-1,3-benzothiazol-6-yl)-1-{[2-(4-methylpiperazin-1-yl)quinolin-3-yl]methyl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine (C27 H26 N10 S, 522.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
RW4
Formula
C27 H26 N10 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

RW4 in 2 structures; the first of them:

  • 2WXK · The crystal structure of the murine class IA PI 3-kinase p110delta in complex with INK666. · RW4 A1500 · binds THR750, PHE751, MET752, PRO758, LEU759, TRP760, ILE777, LYS779 and 13 more
  • 2WXK · The crystal structure of the murine class ia pi 3-kinase P110DELTA in complex with INK666. · RW4 A1500 · binds THR750, PHE751, MET752, PRO758, LEU759, TRP760, ILE777, LYS779 and 13 more

Residues it binds most

ASP 2, ILE 2, LEU 2, MET 2, VAL 2, ASN 2, GLU 2, LYS 2, PHE 2, PRO 2 (residue and the binding sites it lines).

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