Prediction of allosteric sites and signalling: insights from benchmarking datasets (results data)

On the top level the Bond_to_bond_propensity_results.zip file contains two folders which are described in detail below:ASBench:1. Results of bond-to-bond propensity analysis on the protein structures (with allosteric ligands) from the ASBench database.2. Results of bond-to-bond propensity analysis on the protein structures (without allosteric ligands) from the ASBench database.CASBench:1. Results of bond-to-bond propensity analysis on the protein structures (orthosteric ligands as the source) from the CASBench database.2. Results of bond-to-bond propensity analysis on the protein structures (orthosteric residues as the source) from the CASBench database.顶层目录下的Bond_to_bond_propensity_results.zip压缩包包含两个子文件夹，下文将对其进行详细说明： ASBench： 1. 针对ASBench数据库中结合变构配体的蛋白质结构开展的键-键倾向分析结果 2. 针对ASBench数据库中未结合变构配体的蛋白质结构开展的键-键倾向分析结果 CASBench： 1. 针对CASBench数据库中以正构配体为作用源的蛋白质结构开展的键-键倾向分析结果 2. 针对CASBench数据库中以正构残基为作用源的蛋白质结构开展的键-键倾向分析结果