China Pharmaceutical University

About Us

The physicochemical properties and binding modes of protein-ligand complexes are crucial for studying protein functions, predicting protein binding pockets, screening small molecule ligands, and designing drugs. To this end, we have created CpuPDB

CpuPDB is a comprehensive 3D database of protein-ligand binding sites and cavities. CpuPDB aims to provide detailed information on protein-ligand binding cavities, binding sites, and interaction forces by processing data from the Protein Data Bank (PDB)

CpuPDB includes

  • 10,154 uniq59477ue proteins and 14,032 ligands
  • interaction force calculation data for 89477 cavities and 102183 binding sites
  • eight distinct interaction types including hydrogen bonds and salt bridges at each binding site
  • detailed annotations of the physicochemical properties of proteins and their ligands

CpuPDB can significantly advance the fields of structural biology and drug discovery

Contact

Please contact us through the following way, welcome your visit

Our Address

639 Longmian Avenue, Jiangning District, Nanjing City, Jiangsu Province

Email Us

liaojun@cpu.edu.cn

 

Call Us

+86 025-86185160