| Complexes [Theoretical pKd] | File | Volume (A3)
(FPocket) | Hydrophobicity
Score(FPocket) | Contacts Ligand/Receptor [<4A] in Site C4_S1 |
| Complex: CIT_A_2(2AEX) / Model_7(2AEX/A) = [3.6]
| Download | 509.16 | 18.40 | MKEQKIQAFEWFRALRDRVVESFLLIEGQSPTDPKIEKRKWDRPGGGGGESTIIYGDVFEKVGVNISKVYGKFADSVVNEIPGASESNGEFWASGISLVSHMQSPLVPAAHMNTRLIYTSKQWFGGGMDFTPTYKNEEDYKYIHESIKTTCDKFDAEYYLKFKEQCDNYFFLQHRKEPRGIGGIFYDNLNSGRWENDFEFTKAVGETFLKIYLHIIRQHMRKPWTKEQRETQLIKRGRYVEFNLLYDRGTKFGLMTDGNPDAIMMSMPPLVKWM |
| Complex: CIT_A_2(2AEX) / Model_25(2AEX/A) = [4.3]
| Download | 604.51 | 14.32 | MKEQKIQAFEWFRALRDRVVESFLLIEGQSPTDPKIEKRKWDRPGGGGGESTIIYGDVFEKVGVNISKVYGKFADSVVNEIPGASESNGEFWASGISLVSHMQSPLVPAAHMNTRLIYTSKQWFGGGMDFTPTYKNEEDYKYIHESIKTTCDKFDAEYYLKFKEQCDNYFFLQHRKEPRGIGGIFYDNLNSGRWENDFEFTKAVGETFLKIYLHIIRQHMRKPWTKEQRETQLIKRGRYVEFNLLYDRGTKFGLMTDGNPDAIMMSMPPLVKWM |
Consensus
[pKd Mean = 3.95] | - | 556
(s=47) | 16
(s=2) | MKEQKIQAFEWFRALRDRVVESFLLIEGQSPTDPKIEKRKWDRPGGGGGESTIIYGDVFEKVGVNISKVYGKFADSVVNEIPGASESNGEFWASGISLVSHMQSPLVPAAHMNTRLIYTSKQWFGGGMDFTPTYKNEEDYKYIHESIKTTCDKFDAEYYLKFKEQCDNYFFLQHRKEPRGIGGIFYDNLNSGRWENDFEFTKAVGETFLKIYLHIIRQHMRKPWTKEQRETQLIKRGRYVEFNLLYDRGTKFGLMTDGNPDAIMMSMPPLVKWM |