Study : 682_tI_BRADI (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

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Binding Site Number :C1_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 C1_S1
Complex: HP6_G_7(2ALG) / Model_24(2ALG/A) = [3.1] Download654.6446.80AISCGQVNSAVGPCLSYARGTGASPSAACCNGVKSLAAAAKSSADKKAACACLKSAAGRMSGLNAGNAAAIPSKCGVSIPYTISPSVDCSRVN
Complex: LPC_A_4(1BWO) / Model_26(1BWO/A) = [5.3] Download1416.0241.42AISCGQVNSAVGPCLSYARGTGASPSAACCNGVKSLAAAAKSSADKKAACACLKSAAGRMSGLNAGNAAAIPSKCGVSIPYTISPSVDCSRVN
Complex: OLA_A_2(1FK5) / Model_11(1FK5/A) = [6.0] Download1091.1753.42AISCGQVNSAVGPCLSYARGTGASPSAACCNGVKSLAAAAKSSADKKAACACLKSAAGRMSGLNAGNAAAIPSKCGVSIPYTISPSVDCSRVN
Complex: LPC_A_3(1BWO) / Model_26(1BWO/A) = [6.4] Download1671.5643.54AISCGQVNSAVGPCLSYARGTGASPSAACCNGVKSLAAAAKSSADKKAACACLKSAAGRMSGLNAGNAAAIPSKCGVSIPYTISPSVDCSRVN
Consensus
[pKd Mean = 5.20]
-1208
(s=380)
46
(s=4)
AISCGQVNSAVGPCLSYARGTGASPSAACCNGVKSLAAAAKSSADKKAACACLKSAAGRMSGLNAGNAAAIPSKCGVSIPYTISPSVDCSRVN