Study : B4V000_9ACTN (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

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Binding Site Number :C5_S1
Best Complexes choosen after comparative docking [pKd > 3] : 1 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C5_S1
Complex: AMP_A_3(4R78) / Model_35(4R78/A) = [3.9] Download958.2729.24MTQAALAPGGFDEFEMHQVLKRGCAAVGLDSSEARLLRGHTNAVIHLVKEHVVVKIARKGSRIDDVARTVRFVRWLMDAGFPTVSLHPVDQPVGVGQHALTFWEYLPQPSDPVPAAQLAKPLYSLHTLPASPEALPAHDNLAAIRRSLKSITCLSDEALAFLNGSTEQLESALHVVQFELPEGVIQGDPQHRNALHTASGGAVLCDWDTVAIGQPEWDLVTVEVHCRRFGHGSQHYEAFANTYGWDVTRWSGYQTLAAIRELRMITTNARKVSDAPTSLQEVERRVEGLRCHDRALRWNIL
Consensus
[pKd Mean = 3.90]
-958
(s=0)
29
(s=0)
MTQAALAPGGFDEFEMHQVLKRGCAAVGLDSSEARLLRGHTNAVIHLVKEHVVVKIARKGSRIDDVARTVRFVRWLMDAGFPTVSLHPVDQPVGVGQHALTFWEYLPQPSDPVPAAQLAKPLYSLHTLPASPEALPAHDNLAAIRRSLKSITCLSDEALAFLNGSTEQLESALHVVQFELPEGVIQGDPQHRNALHTASGGAVLCDWDTVAIGQPEWDLVTVEVHCRRFGHGSQHYEAFANTYGWDVTRWSGYQTLAAIRELRMITTNARKVSDAPTSLQEVERRVEGLRCHDRALRWNIL