Title : Deciphering the binding behavior of flavonoids to the cyclin dependent kinase 6/cyclin D complex.

Pub. Date : 2018

PMID : 29715320






5 Functional Relationships(s)
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1 Deciphering the binding behavior of flavonoids to the cyclin dependent kinase 6/cyclin D complex. Flavonoids cyclin dependent kinase 6 Homo sapiens
2 Flavonoids, a class of natural compounds with variable phenolic structures, have been found to possess anti-cancer activities by modulating different enzymes and receptors like CDK6. Flavonoids cyclin dependent kinase 6 Homo sapiens
3 The binding efficiencies of flavonoids against the CDK6/cyclin D complex were mainly through the electrostatic (especially the H-bond force) and vdW interactions with residues ILE19, VAL27, ALA41, GLU61, PHE98, GLN103, ASP163 and LEU152. Flavonoids cyclin dependent kinase 6 Homo sapiens
4 The order of binding affinities of these flavonoids toward the CDK6/cyclin D was M03 > M01 > M07 > M15 > M06 > M05 > M04. Flavonoids cyclin dependent kinase 6 Homo sapiens
5 It is anticipated that the binding features of flavonoid inhibitors studied in the present work may provide valuable insights for the development of CDK6 inhibitors. Flavonoids cyclin dependent kinase 6 Homo sapiens