Study : 234_tI_CITSI (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

Download fasta file
Download text file


Binding Site Number :C3_S1
Best Complexes choosen after comparative docking [pKd > 3] : 4 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C3_S1
Complex: LPC_A_4(1BWO) / Model_6(1BWO/A) = [3.8] Download1191.1044.81ITCGQVSGSLAPCIGFLRSGGPIPMPCCNGVRSLNAAARTTPDRQTACNCLKQAAGSIPNLNLNNAAGLPGACGVSIPYKISTSTDCSKVR
Complex: DAO_E_5(2ALG) / Model_1(2ALG/A) = [3.9] Download662.2839.46ITCGQVSGSLAPCIGFLRSGGPIPMPCCNGVRSLNAAARTTPDRQTACNCLKQAAGSIPNLNLNNAAGLPGACGVSIPYKISTSTDCSKVR
Complex: OLA_A_2(1FK5) / Model_30(1FK5/A) = [5.4] Download1210.1643.11ITCGQVSGSLAPCIGFLRSGGPIPMPCCNGVRSLNAAARTTPDRQTACNCLKQAAGSIPNLNLNNAAGLPGACGVSIPYKISTSTDCSKVR
Complex: LPC_A_3(1BWO) / Model_6(1BWO/A) = [6.9] Download1615.8841.97ITCGQVSGSLAPCIGFLRSGGPIPMPCCNGVRSLNAAARTTPDRQTACNCLKQAAGSIPNLNLNNAAGLPGACGVSIPYKISTSTDCSKVR
Consensus
[pKd Mean = 5.00]
-1169
(s=338)
42
(s=1)
ITCGQVSGSLAPCIGFLRSGGPIPMPCCNGVRSLNAAARTTPDRQTACNCLKQAAGSIPNLNLNNAAGLPGACGVSIPYKISTSTDCSKVR