Dataset: PI3KG
Key Value Description Download
Target PI3KG gene id ###
Name Phosphoinositid-3-Kinase gamma protein name ###
Super-family Kinase protein class ###
PDB ID 3dbs the protein structure in TocoDDB click here
Pocket (x, y, z) 21.75, 63.70, 20.60 the center coordinate of the protein pocket click here
Actives 40 the number of active ligands ###
Topology decoys 2004 the number pf topology decoys click here
Conformation decoys 1006 the number of decoy conformations click here
Decoys 3010 the number of total decoys ###
Total 3050 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 297 0 3 1 0.400 75.250 50.167 15.050 0.960 0.527 0.863