Study : Wbm0385 (atomeDB@cbs.cnrs.fr)


Main Binding Site Prediction:


Binding Site Prediction

Download fasta file
Download text file


Binding Site Number :C7_S1
Best Complexes choosen after comparative docking [pKd > 3] : 5 (5 maxi)

Complexes [Theoretical pKd]FileVolume (A3)
(FPocket)		Hydrophobicity
Score(FPocket)		Contacts Ligand/Receptor [<4A] in Site C7_S1
Complex: CP_B_11(3R7F) / Model_27(3R7F/B) = [3.5] Download235.835.17MSNRKDLLSVLDFTVNDVGNIIELAGQYLENKAANGRILENKTVINLFFEDSTRTLTSFEMAAKSLGANVVTLPVKSSSINKGEDLTDMIKTLNAMNPDYIVVRQKSSGIVNMLAKHVSCLLINAGDGSSEHPTQALADYFVISSHKKQIKNLKIVICGDILHSRVARSNIRLLKMFGAKICLVAPPTLICKHFPEVDSIYYSLIEGIKDADVIMLLRLQKERMNSGCFIPSNREYFYLYGLDSQKLLCAKSNAIVMHPGPINRGIEISSDITDHIILQQVEFGLAIRKAVLHYYRPC
Complex: FLC_B_5(3D6N) / Model_5(3D6N/B) = [3.7] Download671.8514.06MSNRKDLLSVLDFTVNDVGNIIELAGQYLENKAANGRILENKTVINLFFEDSTRTLTSFEMAAKSLGANVVTLPVKSSSINKGEDLTDMIKTLNAMNPDYIVVRQKSSGIVNMLAKHVSCLLINAGDGSSEHPTQALADYFVISSHKKQIKNLKIVICGDILHSRVARSNIRLLKMFGAKICLVAPPTLICKHFPEVDSIYYSLIEGIKDADVIMLLRLQKERMNSGCFIPSNREYFYLYGLDSQKLLCAKSNAIVMHPGPINRGIEISSDITDHIILQQVEFGLAIRKAVLHYYRPC
Complex: CP_C_16(3R7F) / Model_26(3R7F/C) = [4.2] Download412.158.07MSNRKDLLSVLDFTVNDVGNIIELAGQYLENKAANGRILENKTVINLFFEDSTRTLTSFEMAAKSLGANVVTLPVKSSSINKGEDLTDMIKTLNAMNPDYIVVRQKSSGIVNMLAKHVSCLLINAGDGSSEHPTQALADYFVISSHKKQIKNLKIVICGDILHSRVARSNIRLLKMFGAKICLVAPPTLICKHFPEVDSIYYSLIEGIKDADVIMLLRLQKERMNSGCFIPSNREYFYLYGLDSQKLLCAKSNAIVMHPGPINRGIEISSDITDHIILQQVEFGLAIRKAVLHYYRPC
Complex: CP_A_4(3R7F) / Model_55(3R7F/A) = [4.5] Download365.1010.44MSNRKDLLSVLDFTVNDVGNIIELAGQYLENKAANGRILENKTVINLFFEDSTRTLTSFEMAAKSLGANVVTLPVKSSSINKGEDLTDMIKTLNAMNPDYIVVRQKSSGIVNMLAKHVSCLLINAGDGSSEHPTQALADYFVISSHKKQIKNLKIVICGDILHSRVARSNIRLLKMFGAKICLVAPPTLICKHFPEVDSIYYSLIEGIKDADVIMLLRLQKERMNSGCFIPSNREYFYLYGLDSQKLLCAKSNAIVMHPGPINRGIEISSDITDHIILQQVEFGLAIRKAVLHYYRPC
Complex: CP_A_4(3R7F) / Model_2(3R7F/A) = [4.5] Download383.7710.44MSNRKDLLSVLDFTVNDVGNIIELAGQYLENKAANGRILENKTVINLFFEDSTRTLTSFEMAAKSLGANVVTLPVKSSSINKGEDLTDMIKTLNAMNPDYIVVRQKSSGIVNMLAKHVSCLLINAGDGSSEHPTQALADYFVISSHKKQIKNLKIVICGDILHSRVARSNIRLLKMFGAKICLVAPPTLICKHFPEVDSIYYSLIEGIKDADVIMLLRLQKERMNSGCFIPSNREYFYLYGLDSQKLLCAKSNAIVMHPGPINRGIEISSDITDHIILQQVEFGLAIRKAVLHYYRPC
Consensus
[pKd Mean = 4.08]		-413
(s=142)		9
(s=3)		MSNRKDLLSVLDFTVNDVGNIIELAGQYLENKAANGRILENKTVINLFFEDSTRTLTSFEMAAKSLGANVVTLPVKSSSINKGEDLTDMIKTLNAMNPDYIVVRQKSSGIVNMLAKHVSCLLINAGDGSSEHPTQALADYFVISSHKKQIKNLKIVICGDILHSRVARSNIRLLKMFGAKICLVAPPTLICKHFPEVDSIYYSLIEGIKDADVIMLLRLQKERMNSGCFIPSNREYFYLYGLDSQKLLCAKSNAIVMHPGPINRGIEISSDITDHIILQQVEFGLAIRKAVLHYYRPC