By manipulating the receptors association geometry, we managed to induce biased, and more selective, signaling along the G-CSF axis.
paper: https://t.co/7YdRUi0RXK
The HECTOR method is now out, where starting from maximal steric complementarity could achieve high-affinity binders, with experimental validation against VEGF and IL-7Ra as targets.
paper: https://t.co/AVBHIyEG9X
code: https://t.co/KMH5OL3frj
Our paper on the Protein Design Archive has just been published in @NatureBiotech! It describes our web application for exploring designed proteins (link ⬇️) and contains analysis of how they have changed over time. @MartaChronowska@mjstam@WoolfsonLab
https://t.co/7aa50oYRqQ
D-amino acids are now available in all design and MD protocols, on standalone and server software.
The table of valid input 3-letter codes: https://t.co/Hn302sFSto
Blocking cytokine signaling can be an effective therapy for a range of different diseases. @m_elgamacy &co use computational protein design to develop novel #cytokine receptor antagonists, showing G-CSFR inhibition in a cell model of AML #PLOSBiology https://t.co/artoueBUEL
By designing bivalent binders that lock a cytokine receptor into a non-signaling assembly, Timo has managed to create the most potent (and most stable) G-CSFR antagonists to date!
For details: https://t.co/hRhO4ssx4W
📢The future Pereira lab is hiring! We will start at @_VIB_AI in February 2025 and are looking for a postdoc to join and kick-start our team 🤓 If you want to leverage AI and large networks to explore and understand the protein universe 🌌, check below! https://t.co/R7n5vam6mS
We have up to three HiWi (1 year contract) and/or Master's thesis projects in Tuebingen on topics of: i) deimmunization of synthetic cytokines, ii) Optimization of metal-binding proteins, or iii) Characterization of cell-penetrating peptides. Please, get in touch if interested.
The upgraded rotamer library (v1.60->v1.95):
- Glycine padding; Ac-GLY-X-GLY-NHMe instead of Ac-X-NHMe
- Higher temperature; 310 K instead of 293 K
- Simulated using CHARMM36 instead of CHARMM27
We just released the "protein design toolkit", integrating tools from Damietta, ProteinMPNN and OpenMM.
An interactive tutorial is available at the server https://t.co/gmoCK0BbfV. Recommended usage is described in the paper: https://t.co/Uxghy5MO1U and feedback is most welcome!
Here is our new protein design engine. In short, it evaluates interaction energies through a single matrix operation!
We're happy to get your feedback on the early software (https://t.co/ddaOrhSU8h) or web-server (https://t.co/hwXm87GctW); high-performance releases to follow.