Robust deep learning–based protein sequence design using ProteinMPNN
Although deep learning has revolutionized protein structure prediction, almost all
experimentally characterized de novo protein designs have been generated using …
experimentally characterized de novo protein designs have been generated using …
Chemoenzymatic semisynthesis of proteins
RE Thompson, TW Muir - Chemical reviews, 2019 - ACS Publications
Protein semisynthesis—defined herein as the assembly of a protein from a combination of
synthetic and recombinant fragments—is a burgeoning field of chemical biology that has …
synthetic and recombinant fragments—is a burgeoning field of chemical biology that has …
Scaffolding protein functional sites using deep learning
The binding and catalytic functions of proteins are generally mediated by a small number of
functional residues held in place by the overall protein structure. Here, we describe deep …
functional residues held in place by the overall protein structure. Here, we describe deep …
Generalized biomolecular modeling and design with RoseTTAFold All-Atom
Deep-learning methods have revolutionized protein structure prediction and design but are
presently limited to protein-only systems. We describe RoseTTAFold All-Atom (RFAA), which …
presently limited to protein-only systems. We describe RoseTTAFold All-Atom (RFAA), which …
Hallucinating symmetric protein assemblies
Deep learning generative approaches provide an opportunity to broadly explore protein
structure space beyond the sequences and structures of natural proteins. Here, we use deep …
structure space beyond the sequences and structures of natural proteins. Here, we use deep …
Improving protein expression, stability, and function with ProteinMPNN
Natural proteins are highly optimized for function but are often difficult to produce at a scale
suitable for biotechnological applications due to poor expression in heterologous systems …
suitable for biotechnological applications due to poor expression in heterologous systems …
Multistate and functional protein design using RoseTTAFold sequence space diffusion
SL Lisanza, JM Gershon, SWK Tipps, JN Sims… - Nature …, 2024 - nature.com
Protein denoising diffusion probabilistic models are used for the de novo generation of
protein backbones but are limited in their ability to guide generation of proteins with …
protein backbones but are limited in their ability to guide generation of proteins with …
De novo design of allosterically switchable protein assemblies
Allosteric modulation of protein function, wherein the binding of an effector to a protein
triggers conformational changes at distant functional sites, plays a central part in the control …
triggers conformational changes at distant functional sites, plays a central part in the control …
Binding and sensing diverse small molecules using shape-complementary pseudocycles
We describe an approach for designing high-affinity small molecule–binding proteins poised
for downstream sensing. We use deep learning–generated pseudocycles with repeating …
for downstream sensing. We use deep learning–generated pseudocycles with repeating …
Reconfigurable asymmetric protein assemblies through implicit negative design
Asymmetric multiprotein complexes that undergo subunit exchange play central roles in
biology but present a challenge for design because the components must not only contain …
biology but present a challenge for design because the components must not only contain …