Complexes [Theoretical pKd] | File | Volume (A3) (FPocket) | Hydrophobicity Score(FPocket) | Contacts Ligand/Receptor [<4A] in Site C2_S1 |
Complex: EDO_A_10(5FTG) / Model_44(5FTG/A) = [3.2]
| Download | 849.01 | 33.40 | MLIEDKIVEIATRVFQVNEIDVRVDSRFKGGMSNYTYLVYVKEQPYVIRIIGDGGEVLVKPSIEKKHIQQAKALNLNSELVYFDSKTGVKVSKYVEGTPLSVSMEETDYPLVANALKTLHQAKLPGEDYGLKERLRRYEKLLKKEPSTTYYTLKMQWLKLYDAYFSKLPKVLCHGDAQRSNLVKSGDKIYLLDWEFSGLNDPYYDIASFGNIDFKDAEKLLGYYLERTPSAFELAHIRFYRMYQVLQWHIVATYKHEINLSEKLHLDFEMIAGKYLSLAGHFLEQLKEIEQFK |
Complex: AMP_A_3(4R78) / Model_2(4R78/A) = [3.8]
| Download | 1010.00 | 30.64 | MLIEDKIVEIATRVFQVNEIDVRVDSRFKGGMSNYTYLVYVKEQPYVIRIIGDGGEVLVKPSIEKKHIQQAKALNLNSELVYFDSKTGVKVSKYVEGTPLSVSMEETDYPLVANALKTLHQAKLPGEDYGLKERLRRYEKLLKKEPSTTYYTLKMQWLKLYDAYFSKLPKVLCHGDAQRSNLVKSGDKIYLLDWEFSGLNDPYYDIASFGNIDFKDAEKLLGYYLERTPSAFELAHIRFYRMYQVLQWHIVATYKHEINLSEKLHLDFEMIAGKYLSLAGHFLEQLKEIEQFK |
Complex: AMP_A_3(4R78) / Model_31(4R78/A) = [4.0]
| Download | 923.75 | 31.35 | MLIEDKIVEIATRVFQVNEIDVRVDSRFKGGMSNYTYLVYVKEQPYVIRIIGDGGEVLVKPSIEKKHIQQAKALNLNSELVYFDSKTGVKVSKYVEGTPLSVSMEETDYPLVANALKTLHQAKLPGEDYGLKERLRRYEKLLKKEPSTTYYTLKMQWLKLYDAYFSKLPKVLCHGDAQRSNLVKSGDKIYLLDWEFSGLNDPYYDIASFGNIDFKDAEKLLGYYLERTPSAFELAHIRFYRMYQVLQWHIVATYKHEINLSEKLHLDFEMIAGKYLSLAGHFLEQLKEIEQFK |
Complex: ADP_B_9(3MES) / Model_41(3MES/B) = [6.0]
| Download | 1082.43 | 21.23 | MLIEDKIVEIATRVFQVNEIDVRVDSRFKGGMSNYTYLVYVKEQPYVIRIIGDGGEVLVKPSIEKKHIQQAKALNLNSELVYFDSKTGVKVSKYVEGTPLSVSMEETDYPLVANALKTLHQAKLPGEDYGLKERLRRYEKLLKKEPSTTYYTLKMQWLKLYDAYFSKLPKVLCHGDAQRSNLVKSGDKIYLLDWEFSGLNDPYYDIASFGNIDFKDAEKLLGYYLERTPSAFELAHIRFYRMYQVLQWHIVATYKHEINLSEKLHLDFEMIAGKYLSLAGHFLEQLKEIEQFK |
Complex: ADP_A_3(3MES) / Model_42(3MES/A) = [6.2]
| Download | 1314.91 | 21.96 | MLIEDKIVEIATRVFQVNEIDVRVDSRFKGGMSNYTYLVYVKEQPYVIRIIGDGGEVLVKPSIEKKHIQQAKALNLNSELVYFDSKTGVKVSKYVEGTPLSVSMEETDYPLVANALKTLHQAKLPGEDYGLKERLRRYEKLLKKEPSTTYYTLKMQWLKLYDAYFSKLPKVLCHGDAQRSNLVKSGDKIYLLDWEFSGLNDPYYDIASFGNIDFKDAEKLLGYYLERTPSAFELAHIRFYRMYQVLQWHIVATYKHEINLSEKLHLDFEMIAGKYLSLAGHFLEQLKEIEQFK |
Consensus [pKd Mean = 4.64] | - | 1036 (s=160) | 27 (s=5) | MLIEDKIVEIATRVFQVNEIDVRVDSRFKGGMSNYTYLVYVKEQPYVIRIIGDGGEVLVKPSIEKKHIQQAKALNLNSELVYFDSKTGVKVSKYVEGTPLSVSMEETDYPLVANALKTLHQAKLPGEDYGLKERLRRYEKLLKKEPSTTYYTLKMQWLKLYDAYFSKLPKVLCHGDAQRSNLVKSGDKIYLLDWEFSGLNDPYYDIASFGNIDFKDAEKLLGYYLERTPSAFELAHIRFYRMYQVLQWHIVATYKHEINLSEKLHLDFEMIAGKYLSLAGHFLEQLKEIEQFK |