User profiles for Marion Schuller

Dr Marion Schuller

Postdoctoral Researcher, Oxford University
Verified email at path.ox.ac.uk
Cited by 518

Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking

M Schuller, GJ Correy, S Gahbauer, D Fearon, T Wu… - Science …, 2021 - science.org
The severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) macrodomain within
the nonstructural protein 3 counteracts host-mediated antiviral adenosine diphosphate–…

Molecular basis for DarT ADP-ribosylation of a DNA base

M Schuller, RE Butler, A Ariza, C Tromans-Coia… - Nature, 2021 - nature.com
ADP-ribosyltransferases use NAD + to catalyse substrate ADP-ribosylation 1 , and thereby
regulate cellular pathways or contribute to toxin-mediated pathogenicity of bacteria 2 , 3 – 4 . …

Beyond protein modification: the rise of non-canonical ADP-ribosylation

M Schuller, I Ahel - Biochemical Journal, 2022 - portlandpress.com
ADP-ribosylation has primarily been known as post-translational modification of proteins. As
signalling strategy conserved in all domains of life, it modulates substrate activity, …

[HTML][HTML] Exploring protein hotspots by optimized fragment pharmacophores

…, D Fearon, F von Delft, M Schuller… - Nature …, 2021 - nature.com
Fragment-based drug design has introduced a bottom-up process for drug development, with
improved sampling of chemical space and increased effectiveness in early drug discovery. …

PARP14 is a PARP with both ADP-ribosyl transferase and hydrolase activities

…, JD Elsborg, D Munnur, K Zhu, M Schuller… - Science …, 2023 - science.org
PARP14 is a mono–ADP-ribosyl transferase involved in the control of immunity, transcription,
and DNA replication stress management. However, little is known about the ADP-…

Updated protein domain annotation of the PARP protein family sheds new light on biological function

…, K Zhu, D Baretić, S Goffinont, M Schuller… - Nucleic Acids …, 2023 - academic.oup.com
AlphaFold2 and related computational tools have greatly aided studies of structural biology
through their ability to accurately predict protein structures. In the present work, we explored …

Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2

S Gahbauer, GJ Correy, M Schuller… - Proceedings of the …, 2023 - National Acad Sciences
The nonstructural protein 3 (NSP3) of the severe acute respiratory syndrome-coronavirus-2 (SARS-CoV-2)
contains a conserved macrodomain enzyme (Mac1) that is critical for …

[PDF][PDF] Modular antibodies reveal DNA damage-induced mono-ADP-ribosylation as a second wave of PARP1 signaling

…, EP Jurado, R Fajka-Boja, T Colby, M Schuller… - Molecular Cell, 2023 - cell.com
PARP1, an established anti-cancer target that regulates many cellular pathways, including
DNA repair signaling, has been intensely studied for decades as a poly(ADP-ribosyl)…

Viral macrodomains: a structural and evolutionary assessment of the pharmacological potential

JGM Rack, V Zorzini, Z Zhu, M Schuller… - Open …, 2020 - royalsocietypublishing.org
Viral macrodomains possess the ability to counteract host ADP-ribosylation, a post-translational
modification implicated in the creation of an antiviral environment via immune response …

[HTML][HTML] Structural insights into the MMACHC-MMADHC protein complex involved in vitamin B12 trafficking

DS Froese, J Kopec, F Fitzpatrick, M Schuller… - Journal of Biological …, 2015 - ASBMB
Conversion of vitamin B 12 (cobalamin, Cbl) into the cofactor forms methyl-Cbl (MeCbl) and
adenosyl-Cbl (AdoCbl) is required for the function of two crucial enzymes, mitochondrial …