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Computational design of a synthetic PD-1 agonist

Cassie M. Bryan, Gabriel J. Rocklin, Matthew J. Bick, Alex Ford, Sonia Majri-Morrison, Ashley V. Kroll, Chad J. Miller, Lauren Carter, Inna Goreshnik, Alex Kang, Frank DiMaio, Kristin V. Tarbell, David Baker

2021Proceedings of the National Academy of Sciences67 citationsDOIOpen Access PDF

Abstract

of ∼100 nM. The apo crystal structure shows that the binder folds as designed with a backbone RMSD of 1.3 Å to the design model. Trimerization of PD-MP1 resulted in a PD-1 agonist that strongly inhibits murine T cell activation. This small, hyperstable PD-1 binding protein was computationally designed with an all-beta interface, and the trimeric agonist could contribute to treatments for autoimmune and inflammatory diseases.

Topics & Concepts

AgonistProgrammed cell death 1AntibodyProgrammed cell deathPD-L1CancerChemistryComputational biologyCancer researchMedicineImmunotherapyReceptorImmunologyBiologyInternal medicineBiochemistryApoptosisCancer Immunotherapy and BiomarkersPeptidase Inhibition and AnalysisMonoclonal and Polyclonal Antibodies Research
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