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Ligand · K4W

K4W · 4-[[[5-nitroso-2-[[(2~{R})-1-oxidanylbutan-2-yl]amino]-6-(propan-2-ylamino)pyrimidin-4-yl]amino]methyl]phenol

K4W, 4-[[[5-nitroso-2-[[(2~{R})-1-oxidanylbutan-2-yl]amino]-6-(propan-2-ylamino)pyrimidin-4-yl]amino]methyl]phenol (C18 H26 N6 O3, 374.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site…

Component
K4W
Formula
C18 H26 N6 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

K4W in 1 structure; the first of them:

  • 6RIJ · CDK2/CYCLIN A2 in complex with open-ring 5-nitrosopyrimidine inhibitor LC436 · K4W A301 · binds GLU8, ILE10, GLU12, VAL18, ALA31, VAL64, PHE80, GLU81 and 10 more

Residues it binds most

GLU 2, ASP 2, GLN 2, LEU 2, PHE 2, VAL 2, ALA 2, ASN 2, HIS 2, ILE 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • GOL · Glycerol

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