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Ligand · X9G

X9G · 1-[(1-{2-[(3-chloro-1,2-dimethyl-1H-indol-5-yl)amino]pyrimidin-4-yl}-3-methyl-1H-pyrazol-4-yl)methyl]azetidin-3-ol

X9G, 1-[(1-{2-[(3-chloro-1,2-dimethyl-1H-indol-5-yl)amino]pyrimidin-4-yl}-3-methyl-1H-pyrazol-4-yl)methyl]azetidin-3-ol (C22 H24 Cl N7 O, 437.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
X9G
Formula
C22 H24 Cl N7 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

X9G in 2 structures; the first of them:

  • 4XG9 · Crystal structure of an inhibitor-bound Syk · X9G A700 · binds LEU377, GLY378, VAL385, ALA400, LYS402, GLU420, VAL433, MET448 and 11 more
  • 4XG9 · Crystal structure of an inhibitor-bound syk · X9G A700 · binds LEU377, GLY378, VAL385, ALA400, LYS402, GLU420, VAL433, MET448 and 11 more

Residues it binds most

GLU 4, ALA 4, GLY 4, LEU 4, MET 4, VAL 4, ARG 4, ASN 4, ASP 4, LYS 4 (residue and the binding sites it lines).

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