Dataset: SIRT2
Key Value Description Download
Target SIRT2 gene id ###
Name NAD-Dependent Deacetylase Sirtuin-2 protein name ###
Super-family Hydrolase protein class ###
PDB ID 1j8f the protein structure in TocoDDB click here
Pocket (x, y, z) 17.64, -28.88, 22.05 the center coordinate of the protein pocket click here
Actives 40 the number of active ligands ###
Topology decoys 2016 the number pf topology decoys click here
Conformation decoys 1095 the number of decoy conformations click here
Decoys 3111 the number of total decoys ###
Total 3151 the size of TocoDDB click here
Source DEKOIS the source of active ligands ###
Benchmark
Scoring Function TN FP FN TP F1 Score EF0.5% EF1% EF5% ROAUC PRAUC BedROC
InteractionGraphNet 310 0 2 0 0.000 0.000 0.000 0.000 0.674 0.010 0.000