Dissecting the Supramolecular Dispersion of Fullerenes by Proteins/Peptides: Amino Acid Ranking and Driving Forces for Binding to C(60)

Molecular dynamics simulations were used to quantitatively investigate the interactions between the twenty proteinogenic amino acids and C(60). The conserved amino acid backbone gave a constant energetic interaction ~5.4 kcal mol(−1), while the contribution to the binding due to the amino acid side...

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Detalles Bibliográficos
Autores principales: Marforio, Tainah Dorina, Calza, Alessandro, Mattioli, Edoardo Jun, Zerbetto, Francesco, Calvaresi, Matteo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8583719/
https://www.ncbi.nlm.nih.gov/pubmed/34768997
http://dx.doi.org/10.3390/ijms222111567

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8583719/
https://www.ncbi.nlm.nih.gov/pubmed/34768997
http://dx.doi.org/10.3390/ijms222111567

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