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Ligand · 55S

55S · 6-(cyclohexylmethoxy)-N-[4-(ethylsulfonyl)phenyl]-9H-purin-2-amine

55S, 6-(cyclohexylmethoxy)-N-[4-(ethylsulfonyl)phenyl]-9H-purin-2-amine (C20 H25 N5 O3 S, 415.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
55S
Formula
C20 H25 N5 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

55S in 2 structures; the first of them:

  • 5CYI · CDK2/Cyclin A covalent complex with 6-(cyclohexylmethoxy)-N-(4-(vinylsulfonyl)phenyl)-9H-p… · 55S A301 · binds ILE10, GLY11, GLU12, GLY13, VAL18, ALA31, VAL64, PHE80 and 11 more
  • 5CYI · CDK2/CYCLIN a covalent complex with 6-(cyclohexylmethoxy)-N-(4… · 55S A301 · binds ILE10, GLY11, GLU12, GLY13, VAL18, ALA31, VAL64, PHE80 and 11 more

Residues it binds most

ASP 4, GLN 4, GLU 4, GLY 4, LEU 4, PHE 4, VAL 4, ALA 4, ASN 4, HIS 4 (residue and the binding sites it lines).

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