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Ligand · YA7

YA7 · N-(5-(6-(2-((2S,6R)-2,6-dimethylmorpholino)pyridin-4-yl)-1-oxoisoindolin-4-yl)-2-methoxypyridin-3-yl) methanesulfonamide

YA7, N-(5-(6-(2-((2S,6R)-2,6-dimethylmorpholino)pyridin-4-yl)-1-oxoisoindolin-4-yl)-2-methoxypyridin-3-yl) methanesulfonamide (C26 H29 N5 O5 S, 523.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
YA7
Formula
C26 H29 N5 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

YA7 in 2 structures; the first of them:

  • 7LQ1 · Human PI3KDELTA in complex with compound 28 · YA7 A1101 · binds MET752, SER754, PRO758, TRP760, ILE777, LYS779, LEU784, ASP787 and 12 more
  • 7LQ1 · Human PI3KDELTA in complex with compound 28 · YA7 A1101 · binds MET752, SER754, PRO758, TRP760, ILE777, LYS779, LEU784, ASP787 and 12 more

Residues it binds most

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

Found with

  • CL · Chloride ion

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