SARS-CoV-2 RBD - AlphaFold structures

Published: 2025-01-01

Project - SARS-CoV-2 RBD ‘single mutant’ AlphaFold2 structures - Figshare

In this data release paper (“SARS-CoV-2 RBD deep mutational AlphaFold2 structures carry phenotypic information” by Oz Kilim, Anikó Mentes, Balázs Pál, István Csabai and Ákos Gellért) we provide a curated data-set of all single mutations from each of the 7 main SARS-CoV-2 variants.

This results in 3819X7= 26733 pdb structures. We demonstrate that this data is viable for at least some down-steam machine learning tasks implying it contains information that is physically meaningful and structural variation between mutants is somewhat captured appropriately.

Article

SARS-CoV-2 receptor-binding domain deep mutational AlphaFold2 structures | Scientific Data