Study : 004_tI_WHEAT (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

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Binding Site Number :C4_S1
Best Complexes choosen after comparative docking [pKd > 3] : 2 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C4_S1
Complex: LPC_A_4(1BWO) / Model_16(1BWO/A) = [3.7] Download1453.0635.96AVSCGQVSSALSPCISYARGNGASPSAACCSGVRSLASSARSTADKQAACKCIKSAAAGLNAGKAAGIPTKCGVSIPYAISSSVDCSKIR
Complex: OLA_A_2(1FK5) / Model_29(1FK5/A) = [6.1] Download942.5036.15AVSCGQVSSALSPCISYARGNGASPSAACCSGVRSLASSARSTADKQAACKCIKSAAAGLNAGKAAGIPTKCGVSIPYAISSSVDCSKIR
Consensus
[pKd Mean = 4.90]
-1197
(s=255)
36
(s=0)
AVSCGQVSSALSPCISYARGNGASPSAACCSGVRSLASSARSTADKQAACKCIKSAAAGLNAGKAAGIPTKCGVSIPYAISSSVDCSKIR