Study : Wbm0235 (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] : 4 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)
Hydrophobicity
Score(FPocket)
Contacts Ligand/Receptor [<4A] in Site C4_S1
Complex: OYA_A_2(2QHU) / Model_3(2QHU/A) = [3.4] Download301.4514.29MVEWLISDQLINYNYAVKFMEKKIQQIHNNSSDELVWLLQHPPLYTAGISATDDDVVEKLLPIYKTGRGGKYTYHGPGQRIIYLMLNLKKRNKCDIKLYIRELGSWIINVLKHFNIFGEFKEDRIGVWVNNNGVEEKIAAFGIRLRKWITYHGIALNFSPDLSHYKGIIPCGLKGYGVTSIKELGVKAPLFKLDNILKKEFYKIF
Complex: OC9_A_2(2QHV) / Model_4(2QHV/A) = [3.5] Download501.1917.91MVEWLISDQLINYNYAVKFMEKKIQQIHNNSSDELVWLLQHPPLYTAGISATDDDVVEKLLPIYKTGRGGKYTYHGPGQRIIYLMLNLKKRNKCDIKLYIRELGSWIINVLKHFNIFGEFKEDRIGVWVNNNGVEEKIAAFGIRLRKWITYHGIALNFSPDLSHYKGIIPCGLKGYGVTSIKELGVKAPLFKLDNILKKEFYKIF
Complex: OCA_A_2(2QHS) / Model_13(2QHS/A) = [3.5] Download453.5816.00MVEWLISDQLINYNYAVKFMEKKIQQIHNNSSDELVWLLQHPPLYTAGISATDDDVVEKLLPIYKTGRGGKYTYHGPGQRIIYLMLNLKKRNKCDIKLYIRELGSWIINVLKHFNIFGEFKEDRIGVWVNNNGVEEKIAAFGIRLRKWITYHGIALNFSPDLSHYKGIIPCGLKGYGVTSIKELGVKAPLFKLDNILKKEFYKIF
Complex: OCA_A_2(2QHS) / Model_1(2QHS/A) = [3.5] Download429.0316.00MVEWLISDQLINYNYAVKFMEKKIQQIHNNSSDELVWLLQHPPLYTAGISATDDDVVEKLLPIYKTGRGGKYTYHGPGQRIIYLMLNLKKRNKCDIKLYIRELGSWIINVLKHFNIFGEFKEDRIGVWVNNNGVEEKIAAFGIRLRKWITYHGIALNFSPDLSHYKGIIPCGLKGYGVTSIKELGVKAPLFKLDNILKKEFYKIF
Consensus
[pKd Mean = 3.48]
-421
(s=73)
16
(s=1)
MVEWLISDQLINYNYAVKFMEKKIQQIHNNSSDELVWLLQHPPLYTAGISATDDDVVEKLLPIYKTGRGGKYTYHGPGQRIIYLMLNLKKRNKCDIKLYIRELGSWIINVLKHFNIFGEFKEDRIGVWVNNNGVEEKIAAFGIRLRKWITYHGIALNFSPDLSHYKGIIPCGLKGYGVTSIKELGVKAPLFKLDNILKKEFYKIF