Dataset: MK2
Key Value Description Download
Target MK2 gene id ###
Name MAPK-activated Protein Kinase-2 protein name ###
Super-family Kinase protein class ###
PDB ID 3kc3 the protein structure in TocoDDB click here
Pocket (x, y, z) -6.55, 56.22, -10.70 the center coordinate of the protein pocket click here
Actives 40 the number of active ligands ###
Topology decoys 2008 the number pf topology decoys click here
Conformation decoys 995 the number of decoy conformations click here
Decoys 3003 the number of total decoys ###
Total 3043 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 294 0 0 4 1.000 74.500 74.500 21.286 1.000 1.000 1.310