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Ligand · OOU

OOU · (2~{S})-2-[[4-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]amino]-~{N},4-dimethyl-pentanamide

OOU, (2~{S})-2-[[4-[4-azanyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]amino]-~{N},4-dimethyl-pentanamide (C31 H38 N6 O2, 526.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
OOU
Formula
C31 H38 N6 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

OOU in 2 structures; the first of them:

  • 5H0G · Crystal structure of HCK complexed with a pyrrolo-pyrimidine inhibitor… · OOU A601 · binds LEU273, GLY274, VAL281, ALA293, LYS295, MET314, VAL323, ILE336 and 14 more
  • 5H0G · Crystal structure of hck complexed with a pyrrolo-pyrimidine inhibitor… · OOU A601 · binds LEU273, GLY274, VAL281, ALA293, LYS295, MET314, VAL323, ILE336 and 14 more

Residues it binds most

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

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