Fast and accurate protein structure search with Foldseek

Michel van Kempen(Max Planck Institute for Multidisciplinary Sciences), Stephanie Kim(Seoul National University), Charlotte Tumescheit(Seoul National University), Milot Mirdita(Seoul National University), Jeong-Jae Lee(Seoul National University), Cameron L. M. Gilchrist(Seoul National University), Johannes Söding(Max Planck Institute for Solar System Research), Martin Steinegger(Seoul National University)
Nature Biotechnology
May 8, 2023
Cited by 2,300Open Access
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Abstract

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.


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