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Minimalistic peptidic scaffolds harbouring an artificial carbene-containing amino acid modulate reductase activity.

Karst LenzenMatteo PlanchestainerIsabelle FellerDavid Roura PadrosaFrancesca ParadisiMartin Albrecht
Published in: Chemical communications (Cambridge, England) (2021)
Inspired by the boom of new artificial metalloenzymes, we developed an Fmoc-protected histidinium salt (Hum) as N-heterocyclic carbene precursor. Hum was placed via solid-phase peptide synthesis into short 7-mer peptides. Upon iridation, the metallo-peptidic construct displayed activity in catalytic hydrogenation that outperforms small molecule analogues and which is dependent on the peptide sequence, a typical feature of metalloenzymes.
Keyphrases
  • amino acid
  • small molecule
  • machine learning
  • molecular docking
  • deep learning
  • protein protein