Rationalizing PROTAC-Mediated Ternary Complex Formation Using Rosetta

Bai, N; Miller, SA; Andrianov, GV; Yates, M; Kirubakaran, P; Karanicolas, J

Karanicolas, J (corresponding author), Fox Chase Canc Ctr, Program Mol Therapeut, Philadelphia, PA 19111 USA.

JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2021; 61 (3): 1368

Abstract

Proteolysis-targeting chimaeras (PROTACs) are molecules that combine a target-binding warhead with an E3 ligase-recruiting moiety; by drawing the targ......

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