Study : 430_tI_ZEAMP (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_24(2ALG/A) = [3.6] Download798.1038.35AITCGQVSSAIAPCLSYARGTASGPSTSCCSGVRNLQSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSRVN
Complex: LPC_A_4(1BWO) / Model_25(1BWO/A) = [4.8] Download1381.3541.54AITCGQVSSAIAPCLSYARGTASGPSTSCCSGVRNLQSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSRVN
Complex: LPC_A_3(1BWO) / Model_25(1BWO/A) = [6.0] Download1433.3637.46AITCGQVSSAIAPCLSYARGTASGPSTSCCSGVRNLQSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSRVN
Complex: OLA_A_2(1FK5) / Model_11(1FK5/A) = [6.2] Download1250.8247.37AITCGQVSSAIAPCLSYARGTASGPSTSCCSGVRNLQSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSRVN
Consensus
[pKd Mean = 5.15]
-1215
(s=250)
41
(s=3)
AITCGQVSSAIAPCLSYARGTASGPSTSCCSGVRNLQSAASTAADRRAACNCLKNAARGVSGLNAGNAASIPSKCGVSIPYTISTSTDCSRVN