1. Describe purpose and objective of the modelling exercise
The purpose and goal of the modelling experiment should be provided as
it affects the choice of the approach as well as what types of
biological predictions can be made. Model quality and accuracy depends
on the available data and modelling process. For example, detailed
intra- or intermolecular contacts can only be investigated with homology
modelling. On the other hand, fold recognition methods may be sufficient
for detecting secondary structural elements and their organization.
Example: The structure of the Bruton tyrosine kinase (BTK)
pleckstrin homology (PH) domain was modelled to facilitate
structure-based interpretation of disease-causing variants in X-linked
agammaglobulinemia (XLA).