数据库简述：protein-chemical structural interactions
数据库主要信息：The database of protein-chemical structural interactions includes all existing 3D structures of complexes of proteins with low molecular weight ligands. When one consideres the proteins and chemical vertices of a graph, all these interactions form a network. Biological networks are powerful tools for predicting undocumented relationships between molecules. The underlying principle is that existing interactions between molecules can be used to predict new interactions. For pairs of proteins sharing a common ligand, we use protein and chemical superimpositions combined with fast structural compatibility screens to predict whether additional compounds bound by one protein would bind the other.
University of Heidelberg
Cell Networks,BioQuant,University of Heidelberg,Im Neuenheimer Feld 267,69120 Heidelberg,Germany
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