I'm a computational biologist working as a postdoc in ESPCI.
How does a protein or an RNA works? How could I make one that does this interesting thing? That is the type of question I'm working on.
Don't let the simplicity of this question fool you! Indeed, protein design hides multiple fundamental questions - which essentially shows how little we know about these very well-known molecules. well-known molecules.
Roughly speaking, two approaches are fighting: i) machine learning takes natural protein examples to design new ones, and ii) physics explicitly models the details hidden in protein atoms! I followed the second option, where in collaboration with experimentalists, we not only designed proteins for molecular structure stability but also new catalytic proteins (enzymes). The methods we worked on are implemented in the Proteus Software developed in Thomas Simonson's lab.
There is a natural process by which one gene can hide another gene — these genes are called overlapping genes. This sounds like magic, but it's not! This is simply due to two features of the genetic code: DNA is read by codons (triplets of nucleotides), and the genetic code is redundant.
Overlapping genes have multiple implications in evolutionary theories but not only. We devised an algorithm that can somehow "morph" two genes such that in the end both are intricated (overlap). You could only diferenciate the first gene from the second by reading the genetic sequence in a special way. Bluffing, right ?
After a Master in Bioinformatics at Paris-Saclay University (2015-2017), I started a PhD in Biology at Ecole Polytechnique (Institut Polytechnique de Paris). From 2017 to 2020, I worked on Computational Protein Design under the supervision of Pr. Thomas Simonson in the Structural Biology of the Cell laboratory. Next, I started a postdoc position at the Max Planck Institute for Mathematics in Sciences (Leipzig, Germany), from 2020 to 2022.
2023 |
Journal
Enzyme redesign and genetic code expansion Protein Engineering, Design and Selection, 2023, paper Vaitea Opuu, Thomas Simonson |
Journal
Redesigning methionyl-tRNA synthetase for β-methionine activity with adaptive landscape flattening and experiments Protein Science, 2023, paper Vaitea Opuu, Giuliano Nigro, Christine Lazennec-Schurdevin, Yves Mechulam, Emmanuelle Schmitt , Thomas Simonson |
Journal
High-throughput droplet-based analysis of influenza A virus genetic reassortment by single-virus RNA sequencing PNAS, 2023, paper Kuang-Yu Chen* ,Jayaprakash Karuppusamy*,Mary B. O’Neill*, Vaitea Opuu ,Mathieu Bahin ,Sophie Foulon ,Pablo Ibanez ,Lluis Quintana-Murci ,Tatsuhiko Ozawa ,Sylvie van der Werf ,Philippe Nghe ,Nadia Naffakh ,Andrew Griffiths ,Catherine Isel |
2022 |
Conference
Investigating graph neural network for RNA structural embedding Machine Learning for Structural Biology Workshop, NeurIPS 2022, 2022, paper Vaitea Opuu, Hélène Bret |
Journal
RAFFT: Efficient prediction of RNA folding pathways using the fast Fourier transform Plos Computational Biology, 2022, doi Vaitea Opuu, Nono S. C. Merleau, Vincent Messow, Matteo Smerlak |
Chapter
Knowledge-Based Unfolded State Model for Protein Design methods in Molecular Biology: Computational Peptide Science, 2022 Vaitea Opuu, David Mignon, Thomas Simonson |
2020 |
Journal
Adaptive Landscape Flattening Allows the Design of Both Enzyme: Substrate Binding and Catalytic Power Plos Computational Biology, 2020, doi Vaitea Opuu, Giuliano Nigro, Thomas Gaillard, Emmanuelle Schmitt, Yves Mechulam, Thomas Simonson |
Journal
A Physics-Based Energy Function Allows the Computational Redesign of a Pdz Domain Scientific Reports, 2020, doi Vaitea Opuu*, Young Joo Sun*, Titus Hou, Nicolas Panel, Ernesto J. Fuentes, Thomas Simonson |
Journal
Proteus software for physics-based protein design The Journal of Physical Chemistry Part A, 2020, doi David Mignon, Karen Druart*, Eleni Michael*, Vaitea Opuu*, Savvas Polydorides*, Francesco Villa*, Thomas Gaillard, Nicolas Panel, Georgios Archontis, Thomas Simonson |
Chapter
Computational Design of PDZ-Peptide Binding methods in Molecular Biology: PDZ domains, 2020 Nicolas Panel, Vaitea Opuu, Francesco Villa, David Mignon, Thomas Simonson |
2018 |
Journal
Meet-U: educating through research immersion Plos Computational Biology, 2018, doi Nika Abdollahi, Alexandre Albani, Eric Anthony, Agnes Baud, Mélissa Cardon, Robert Clerc, Dariusz Czernecki, Romain Conte, Laurent David, Agathe Delaune, et al |
Conference
Computational design of fully overlapping coding schemes for portein pairs and triplets (proceeding of) advances in systems and synthetic biology, page 97, 2018 Vaitea Opuu, Martin Silvert, Thomas Simonson |
2017 |
Journal
Computational Design of Fully Overlapping Coding Schemes for Protein Pairs and Triplets Scientific Reports, 2017, doi Vaitea Opuu, Martin Silvert, Thomas Simonson |
Ph.D Thesis
Computational design of proteins and enzymes Institut Polytechnique de Paris, 2020, link Vaitea Opuu |