| Complexes [Theoretical pKd] | File | Volume (A3)
(FPocket) | Hydrophobicity
Score(FPocket) | Contacts Ligand/Receptor [<4A] in Site C1_S1 |
| Complex: MPD_A_3(2H72) / Model_67(2H72/B) = [3.1]
| Download | 146.28 | 28.00 | MTDSEKSATIKVTDASFATDVLSSNKPVLVDFWATWCGPCKMVAPVLEEIATERATDLTVAKLDVDTNPETARNFQVVSIPTLILFKDGQPVKRIVGAKGKAALLRELSDVVPNLN |
| Complex: MPD_A_3(2H6X) / Model_54(2H6X/A) = [3.4]
| Download | 503.82 | 43.89 | MTDSEKSATIKVTDASFATDVLSSNKPVLVDFWATWCGPCKMVAPVLEEIATERATDLTVAKLDVDTNPETARNFQVVSIPTLILFKDGQPVKRIVGAKGKAALLRELSDVVPNLN |
| Complex: MPD_B_6(2TRX) / Model_52(2TRX/B) = [4.2]
| Download | 365.53 | 34.20 | MTDSEKSATIKVTDASFATDVLSSNKPVLVDFWATWCGPCKMVAPVLEEIATERATDLTVAKLDVDTNPETARNFQVVSIPTLILFKDGQPVKRIVGAKGKAALLRELSDVVPNLN |
| Complex: MPD_A_3(2H76) / Model_45(2H76/A) = [4.2]
| Download | 608.19 | 46.44 | MTDSEKSATIKVTDASFATDVLSSNKPVLVDFWATWCGPCKMVAPVLEEIATERATDLTVAKLDVDTNPETARNFQVVSIPTLILFKDGQPVKRIVGAKGKAALLRELSDVVPNLN |
| Complex: PX5_C_7(3O6T) / Model_22(3O6T/C) = [4.5]
| Download | 652.15 | 36.18 | MTDSEKSATIKVTDASFATDVLSSNKPVLVDFWATWCGPCKMVAPVLEEIATERATDLTVAKLDVDTNPETARNFQVVSIPTLILFKDGQPVKRIVGAKGKAALLRELSDVVPNLN |
Consensus
[pKd Mean = 3.88] | - | 455
(s=183) | 37
(s=6) | MTDSEKSATIKVTDASFATDVLSSNKPVLVDFWATWCGPCKMVAPVLEEIATERATDLTVAKLDVDTNPETARNFQVVSIPTLILFKDGQPVKRIVGAKGKAALLRELSDVVPNLN |