Study : 414_tI_ZEADI (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

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Binding Site Number :C2_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 C2_S1
Complex: DAO_E_5(2ALG) / Model_23(2ALG/A) = [3.5] Download896.4829.52AITCGQVSSAIAPCLSYARGTGPAPSASCCSGVRNLKSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSR
Complex: LPC_A_4(1BWO) / Model_24(1BWO/A) = [4.8] Download1477.1838.11AITCGQVSSAIAPCLSYARGTGPAPSASCCSGVRNLKSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSR
Complex: OLA_A_2(1FK5) / Model_10(1FK5/A) = [6.2] Download1201.4641.92AITCGQVSSAIAPCLSYARGTGPAPSASCCSGVRNLKSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSR
Complex: LPC_A_3(1BWO) / Model_24(1BWO/A) = [6.4] Download1600.2832.15AITCGQVSSAIAPCLSYARGTGPAPSASCCSGVRNLKSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSR
Consensus
[pKd Mean = 5.22]
-1293
(s=271)
35
(s=4)
AITCGQVSSAIAPCLSYARGTGPAPSASCCSGVRNLKSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSR