BioXGEM.SiMMap: analysis of site-moiety map

Home

Documentation

Back

Contact us

Target: 2itq_8a  Query compounds:300   Total anchors : 7

Protein Strands Ribbons Cartoons Surface None anchors(on/off) Contents SiMMap (anchors) : 7  anchors Elec(E)    :   Hbond(H) :    vdW(V)    :         Compound : site-moiety map 2itq_8a & 300 compounds Download Binding site SiMMap (anchors) Protein-compound interaction profiles Anchor scores of query compounds Compound search list Compound search     Selected Compound Name

Anchor Pocket Moiety (functional group) H1 63 compounds N 842 D 855 others 20% 12% 11% 8% 7% 42% V1 93 compounds L 718 G 796 L 844 others 27% 24% 10% 5% 5% 28% V2 89 compounds A 767 R 776 L 777 others 32% 26% 12% 5% 4% 20% V3 62 compounds R 705 L 777 L 778 others 26% 23% 12% 1% 1% 37% V4 53 compounds F 795 G 796 C 797 others 30% 27% 6% 3% 3% 30% V5 68 compounds A 767 D 770 others 31% 24% 10% 4% 2% 28% V6 76 compounds V 726 K 745 T 790 others 17% 13% 12% 1% 1% 55%