Binding Site Prediction
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Binding Site Number :C6_S1
Best Complexes choosen after comparative docking [pKd > 3] : 5 (5 maxi)

Complexes [Theoretical pKd]	File	Volume (A3) (FPocket)	Hydrophobicity Score(FPocket)	Contacts Ligand/Receptor [<4A] in Site C6_S1
Complex: CIT_B_2(1WDI) / Model_3(1WDI/A) = [4.0]	Download	506.36	21.45	MKEFDLESYDYHLPKELIANYPVLPKEKAKLLVYERRSQTITHTTFEHVLDFFPKNALVVLNDTKVIKARLFGSKHAFLPSKTTEVFFHRFFKGNTALTQIKGKIKVGDKIFFDANYYAEVLELLHNGQRLIAFYDNQTPLNQENILKLLEQYGHMPLPPYIKRADESLDAHEYQSVFAKHIGAVAAPTASLHFSQNALEKLLKDFKHAFLTLHVGAGTFLSVETKDIREHQIHTEVLHIPKKSQEILQESQEVLCIGTTALRSVEYFKRLKNPNQESFECDIFLHLANPIQHVNHLLTNFHLPKSSLLMLVSAMIGLEKTKEIYKIAIEKKYRFYSYGDGMLIL
Complex: CIT_B_2(1WDI) / Model_24(1WDI/A) = [4.0]	Download	494.50	21.45	MKEFDLESYDYHLPKELIANYPVLPKEKAKLLVYERRSQTITHTTFEHVLDFFPKNALVVLNDTKVIKARLFGSKHAFLPSKTTEVFFHRFFKGNTALTQIKGKIKVGDKIFFDANYYAEVLELLHNGQRLIAFYDNQTPLNQENILKLLEQYGHMPLPPYIKRADESLDAHEYQSVFAKHIGAVAAPTASLHFSQNALEKLLKDFKHAFLTLHVGAGTFLSVETKDIREHQIHTEVLHIPKKSQEILQESQEVLCIGTTALRSVEYFKRLKNPNQESFECDIFLHLANPIQHVNHLLTNFHLPKSSLLMLVSAMIGLEKTKEIYKIAIEKKYRFYSYGDGMLIL
Complex: UNL_A_3(1VKY) / Model_36(1VKY/A) = [4.1]	Download	372.38	9.93	MKEFDLESYDYHLPKELIANYPVLPKEKAKLLVYERRSQTITHTTFEHVLDFFPKNALVVLNDTKVIKARLFGSKHAFLPSKTTEVFFHRFFKGNTALTQIKGKIKVGDKIFFDANYYAEVLELLHNGQRLIAFYDNQTPLNQENILKLLEQYGHMPLPPYIKRADESLDAHEYQSVFAKHIGAVAAPTASLHFSQNALEKLLKDFKHAFLTLHVGAGTFLSVETKDIREHQIHTEVLHIPKKSQEILQESQEVLCIGTTALRSVEYFKRLKNPNQESFECDIFLHLANPIQHVNHLLTNFHLPKSSLLMLVSAMIGLEKTKEIYKIAIEKKYRFYSYGDGMLIL
Complex: UNL_B_4(1VKY) / Model_21(1VKY/B) = [4.1]	Download	383.88	6.44	MKEFDLESYDYHLPKELIANYPVLPKEKAKLLVYERRSQTITHTTFEHVLDFFPKNALVVLNDTKVIKARLFGSKHAFLPSKTTEVFFHRFFKGNTALTQIKGKIKVGDKIFFDANYYAEVLELLHNGQRLIAFYDNQTPLNQENILKLLEQYGHMPLPPYIKRADESLDAHEYQSVFAKHIGAVAAPTASLHFSQNALEKLLKDFKHAFLTLHVGAGTFLSVETKDIREHQIHTEVLHIPKKSQEILQESQEVLCIGTTALRSVEYFKRLKNPNQESFECDIFLHLANPIQHVNHLLTNFHLPKSSLLMLVSAMIGLEKTKEIYKIAIEKKYRFYSYGDGMLIL
Complex: UNL_A_3(1VKY) / Model_23(1VKY/A) = [4.1]	Download	434.83	9.93	MKEFDLESYDYHLPKELIANYPVLPKEKAKLLVYERRSQTITHTTFEHVLDFFPKNALVVLNDTKVIKARLFGSKHAFLPSKTTEVFFHRFFKGNTALTQIKGKIKVGDKIFFDANYYAEVLELLHNGQRLIAFYDNQTPLNQENILKLLEQYGHMPLPPYIKRADESLDAHEYQSVFAKHIGAVAAPTASLHFSQNALEKLLKDFKHAFLTLHVGAGTFLSVETKDIREHQIHTEVLHIPKKSQEILQESQEVLCIGTTALRSVEYFKRLKNPNQESFECDIFLHLANPIQHVNHLLTNFHLPKSSLLMLVSAMIGLEKTKEIYKIAIEKKYRFYSYGDGMLIL
Consensus [pKd Mean = 4.06]	-	438 (s=54)	13 (s=6)	MKEFDLESYDYHLPKELIANYPVLPKEKAKLLVYERRSQTITHTTFEHVLDFFPKNALVVLNDTKVIKARLFGSKHAFLPSKTTEVFFHRFFKGNTALTQIKGKIKVGDKIFFDANYYAEVLELLHNGQRLIAFYDNQTPLNQENILKLLEQYGHMPLPPYIKRADESLDAHEYQSVFAKHIGAVAAPTASLHFSQNALEKLLKDFKHAFLTLHVGAGTFLSVETKDIREHQIHTEVLHIPKKSQEILQESQEVLCIGTTALRSVEYFKRLKNPNQESFECDIFLHLANPIQHVNHLLTNFHLPKSSLLMLVSAMIGLEKTKEIYKIAIEKKYRFYSYGDGMLIL