W. Rungsarityotin,
R. Krause,
A. Schliep,
Max Planck Institute for Molecular Genetics.
A. Schödl, Thinkcell Software.
Predicting protein complexes from the highthroughput experimental data remains a challenge due to uncertainty in their observation. Current methods typically rely on heuristics to first construct an interaction graph from the data and subsequently apply a graphbased clustering method to identify protein complexes. In contrast, we propose a modelbased prediction of protein complexes which uses the observations directly.
We model purifications as observations of protein complexes and formulate a model of protein complexes based on Markov Random Fields incorporating the false negative and false positive rate. We apply our model to predict complexes from the data obtained from hightthroughput experiments without prior elimination of proteins from the sets. We provide an elegant solution to the problem that compares well to other prediction made by two clustering algorithms and to reference data set, particularly for larger unfiltered data sets.
We order the clusters from the highest quality to lowest quality according to the quality score. For each cluster, an assignment to an annotated complex (both MIPS or Reguly) is decided by majority voting with at least half of the proteins in the cluster belonging to that complex.
Spoke model:
Matrix model:
For each clustering solution, we can visualize a matching to MIPS complexes by generating a contingency table whose rows are complexes and columns are clusters. For each cell (i,j) in the table, we count the number of proteins in common between the ith complex and the jth cluster and calculate the Simpson coefficient. We order the diagonal of the table by increasing matching sizes. Clusters without a match to an annotated complex are not part of the table, likewise for complexes without matching to a cluster. The number of clusters and complexes are different for each table. The order of complexes are not the same in all plots.
Data set: Gavin06.
Color scale: Bright color indicates higher Simpson coefficient. See colorbar.
MRF (spoke model).  
MRF (matrix model).  
A solution from MCL with the first cluster as a giant component merging several complexes. 

Gavin06 solution including cores, modules and attachments. This solution has many overlapping clusters due to modules and attachments. 

The core components of the Gavin06 solution. 
MRF (spoke model).
high resolution 

MRF (matrix model). high resolution 

MCL.
high resolution 

Gavin06 (core).
high resolution 