FreshAirTonight / af2complex

Predicting direct protein-protein interactions with AlphaFold deep learning neural network models.
150 stars 19 forks source link

Is it possible to use a known structure (in pdb format) for feature generation and interactions prediction #12

Closed ZKrekhno closed 1 year ago

ZKrekhno commented 1 year ago

I am trying to model interactions with proteins for which the structures are already known (either crystal structures are solved or they have Alphafold predicted structures on Uniprot). Is there a way to just use these pdb files for interactions prediction rather than generating features from basic sequences?

FreshAirTonight commented 1 year ago

You may use PDB structures as templates as part of input features. But the prediction requires sequence input features as well.

ZKrekhno commented 1 year ago

Oh that sounds good. Thank you for the quick reply!