Characterization of Ionizable Groups’ Environments in Proteins and Protein–Ligand Complexes through a Statistical Analysis of the Protein Data Bank

• Alexandre Borrel,
• Anne-Claude Camproux,
• Henri Xhaard

Affiliations

Alexandre Borrel

Molécules Thérapeutiques in silico (MTi), INSERM UMRS-973, University Paris Diderot, Paris Cedex 13, France

Anne-Claude Camproux

Molécules Thérapeutiques in silico (MTi), INSERM UMRS-973, University Paris Diderot, Paris Cedex 13, France

Henri Xhaard

Faculty of Pharmacy, Division of Pharmaceutical Chemistry and Technology, University of Helsinki, Helsinki, Finland