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[Preprint]. 2024 Mar 28:2024.03.27.587068. [Version 1] doi: 10.1101/2024.03.27.587068

Fig. 3. The four-stage scheme for integrative modeling of the baskets.

Fig. 3.

Our integrative approach proceeds through four stages: (1) gathering data, (2) representing subunits and translating the data into spatial restraints, (3) configurational sampling to produce an ensemble of models that satisfies the restraints, and (4) analyzing and validating the ensemble. Stage 1 lists the experimental information used in this study for integrative modeling of baskets of yeast and mammals. Stage 2 lists representation and extracted spatial restraints obtained from information gathered in Stage 1. Stage 3 describes the configurational sampling to search for the models that satisfy the input information. A Gibbs sampling starting from a random initial configuration for the yBasket Nups generates the ensemble of good scoring models. The centroid model of the yBasket ensemble was used to model an initial mammalian basket. A similar Gibbs sampling with additional restraints from the mammalian data and structural equivalence restraint generates the ensemble of good scoring models. Stage 4 lists the model selection and validation protocol for the ensemble of good scoring configuration for both yeast and mammals.