PDBbind v.2013 core set manually curated to optimize the hydrogen bond network considering protein and ligand protonation states. The description of this dataset preparation is published in the follow
PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with Z1545196403 Descriptor: 2-fluoro-N-[(1H-pyrazol-3-yl)methyl]aniline, PH-interacting protein Authors: Grosjean, H, Aimon, A
Molecular docking using models of receptor (protein) and ligand (Testosterone) was carried out using Schrodinger Glide Maestro, USA software. GPCR 205 displayed highest docking score of -8.3Kcal/mol.