Michel {van Kempen}, Stephanie S. Kim, Charlotte Tumescheit, Milot Mirdita, Jeongjae Lee, Cameron L. M. Gilchrist, Johannes Soding, Martin Steinegger. Fast and accurate protein structure search with Foldseek. Nature biotechnology, 42(2):243-246. 2024.
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Abstract:
https://www.youtube.com/watch?v=IJtWTxhuunk As structure prediction methods are generating millions of publicly available protein structures, searching these databases is becoming a bottleneck. Foldseek aligns the structure of a query protein against a database by describing tertiary amino acid interactions within proteins as sequences over a structural alphabet. Foldseek decreases computation times by four to five orders of magnitude with 86%, 88% and 133% of the sensitivities of Dali, TM-align and CE, respectively.