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Ligand · 530

530 · 6-(2,4-difluorophenoxy)-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-amine

530, 6-(2,4-difluorophenoxy)-N-(tetrahydro-2H-pyran-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-amine (C16 H15 F2 N5 O2, 347.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
530
Formula
C16 H15 F2 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

530 in 2 structures; the first of them:

  • 3FMN · P38 kinase crystal structure in complex with RO2530 · 530 A361 · binds VAL38, ALA51, VAL52, LYS53, LEU75, ILE84, LEU86, LEU104 and 9 more
  • 3FMN · P38 kinase crystal structure in complex with RO2530 · 530 A361 · binds VAL38, ALA51, VAL52, LYS53, LEU75, ILE84, LEU86, LEU104 and 9 more

Residues it binds most

LEU 2, ALA 2, VAL 2, ASP 2, HIS 2, ILE 2, LYS 2, MET 2, THR 2 (residue and the binding sites it lines).

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