| Complexes [Theoretical pKd] | File | Volume (A3)
(FPocket) | Hydrophobicity
Score(FPocket) | Contacts Ligand/Receptor [<4A] in Site C4_S1 |
| Complex: GLY_C_3(5JDW) / Model_8(5JDW/A) = [3.3]
| Download | 4201.35 | 24.30 | MAACSLSPVVRWDVSEVGYDDCNIMADTRDGRYVVKIFHTSRSPALCARYVDVVRRVTEAGVAHPRLHRAEGSALLHHRPTGNRLMVMDRVEGITFLDADACPDDTELASVVEQTYRIHALDLYPEYVHDWWAIPQIATLAAEVAHLLTPGDQDRVAAAVETFGRLRVGTLPQVFSHGDLTKANLLRTPCGVPAVLDLAVSNRYARVHDLSMLAVNVLHGSPRPLPERVALLTGLYARHAPLTAAEHAALPGYVLAAAAMELLGAEREWSQGNRSEETRYLRELGRTTLRAAADWALVPALSTSRTRNRAPQDAPHTDERNPMTGPASPVNSWDEFTQLREIIVGDAAHARIPRMTDPSAWLACYPTMTPAELKRVEAGKFPRQVVEESDEDLAQLTKTLRGLGVTTHRPPAVDHSRSFSSPYWEADGYISYCPRDITLVAGSTLIEVASPMRSRYFELFNLRPLFQQYMLEGATWIAAPRPQLRDELYTRDEESRPLLGEAEPVFDAANVLRVGQDFFYQVSRSGNERGLDWLRSTLRLVDPTVRVHPLRDVYGYTHIDSTITVLRPGLVMLNPARIARDEVPEAFRGWDVLWCPEPRPTETALPYHLSEPWISMNLLMVNPELAIADSDQPELLRALEAKGISVLPHRLRHQRVLGGGFHCVTLDIARDGLREDYFG |
| Complex: GLY_C_3(5JDW) / Model_25(5JDW/A) = [3.4]
| Download | 4507.70 | 22.19 | MAACSLSPVVRWDVSEVGYDDCNIMADTRDGRYVVKIFHTSRSPALCARYVDVVRRVTEAGVAHPRLHRAEGSALLHHRPTGNRLMVMDRVEGITFLDADACPDDTELASVVEQTYRIHALDLYPEYVHDWWAIPQIATLAAEVAHLLTPGDQDRVAAAVETFGRLRVGTLPQVFSHGDLTKANLLRTPCGVPAVLDLAVSNRYARVHDLSMLAVNVLHGSPRPLPERVALLTGLYARHAPLTAAEHAALPGYVLAAAAMELLGAEREWSQGNRSEETRYLRELGRTTLRAAADWALVPALSTSRTRNRAPQDAPHTDERNPMTGPASPVNSWDEFTQLREIIVGDAAHARIPRMTDPSAWLACYPTMTPAELKRVEAGKFPRQVVEESDEDLAQLTKTLRGLGVTTHRPPAVDHSRSFSSPYWEADGYISYCPRDITLVAGSTLIEVASPMRSRYFELFNLRPLFQQYMLEGATWIAAPRPQLRDELYTRDEESRPLLGEAEPVFDAANVLRVGQDFFYQVSRSGNERGLDWLRSTLRLVDPTVRVHPLRDVYGYTHIDSTITVLRPGLVMLNPARIARDEVPEAFRGWDVLWCPEPRPTETALPYHLSEPWISMNLLMVNPELAIADSDQPELLRALEAKGISVLPHRLRHQRVLGGGFHCVTLDIARDGLREDYFG |
| Complex: ABU_C_3(6JDW) / Model_9(6JDW/A) = [3.4]
| Download | 374.83 | 6.50 | MAACSLSPVVRWDVSEVGYDDCNIMADTRDGRYVVKIFHTSRSPALCARYVDVVRRVTEAGVAHPRLHRAEGSALLHHRPTGNRLMVMDRVEGITFLDADACPDDTELASVVEQTYRIHALDLYPEYVHDWWAIPQIATLAAEVAHLLTPGDQDRVAAAVETFGRLRVGTLPQVFSHGDLTKANLLRTPCGVPAVLDLAVSNRYARVHDLSMLAVNVLHGSPRPLPERVALLTGLYARHAPLTAAEHAALPGYVLAAAAMELLGAEREWSQGNRSEETRYLRELGRTTLRAAADWALVPALSTSRTRNRAPQDAPHTDERNPMTGPASPVNSWDEFTQLREIIVGDAAHARIPRMTDPSAWLACYPTMTPAELKRVEAGKFPRQVVEESDEDLAQLTKTLRGLGVTTHRPPAVDHSRSFSSPYWEADGYISYCPRDITLVAGSTLIEVASPMRSRYFELFNLRPLFQQYMLEGATWIAAPRPQLRDELYTRDEESRPLLGEAEPVFDAANVLRVGQDFFYQVSRSGNERGLDWLRSTLRLVDPTVRVHPLRDVYGYTHIDSTITVLRPGLVMLNPARIARDEVPEAFRGWDVLWCPEPRPTETALPYHLSEPWISMNLLMVNPELAIADSDQPELLRALEAKGISVLPHRLRHQRVLGGGFHCVTLDIARDGLREDYFG |
| Complex: ARG_A_2(4JDW) / Model_13(4JDW/A) = [3.8]
| Download | 17521.78 | 30.31 | MAACSLSPVVRWDVSEVGYDDCNIMADTRDGRYVVKIFHTSRSPALCARYVDVVRRVTEAGVAHPRLHRAEGSALLHHRPTGNRLMVMDRVEGITFLDADACPDDTELASVVEQTYRIHALDLYPEYVHDWWAIPQIATLAAEVAHLLTPGDQDRVAAAVETFGRLRVGTLPQVFSHGDLTKANLLRTPCGVPAVLDLAVSNRYARVHDLSMLAVNVLHGSPRPLPERVALLTGLYARHAPLTAAEHAALPGYVLAAAAMELLGAEREWSQGNRSEETRYLRELGRTTLRAAADWALVPALSTSRTRNRAPQDAPHTDERNPMTGPASPVNSWDEFTQLREIIVGDAAHARIPRMTDPSAWLACYPTMTPAELKRVEAGKFPRQVVEESDEDLAQLTKTLRGLGVTTHRPPAVDHSRSFSSPYWEADGYISYCPRDITLVAGSTLIEVASPMRSRYFELFNLRPLFQQYMLEGATWIAAPRPQLRDELYTRDEESRPLLGEAEPVFDAANVLRVGQDFFYQVSRSGNERGLDWLRSTLRLVDPTVRVHPLRDVYGYTHIDSTITVLRPGLVMLNPARIARDEVPEAFRGWDVLWCPEPRPTETALPYHLSEPWISMNLLMVNPELAIADSDQPELLRALEAKGISVLPHRLRHQRVLGGGFHCVTLDIARDGLREDYFG |
| Complex: ALA_C_3(8JDW) / Model_11(8JDW/A) = [4.2]
| Download | 8424.91 | 21.40 | MAACSLSPVVRWDVSEVGYDDCNIMADTRDGRYVVKIFHTSRSPALCARYVDVVRRVTEAGVAHPRLHRAEGSALLHHRPTGNRLMVMDRVEGITFLDADACPDDTELASVVEQTYRIHALDLYPEYVHDWWAIPQIATLAAEVAHLLTPGDQDRVAAAVETFGRLRVGTLPQVFSHGDLTKANLLRTPCGVPAVLDLAVSNRYARVHDLSMLAVNVLHGSPRPLPERVALLTGLYARHAPLTAAEHAALPGYVLAAAAMELLGAEREWSQGNRSEETRYLRELGRTTLRAAADWALVPALSTSRTRNRAPQDAPHTDERNPMTGPASPVNSWDEFTQLREIIVGDAAHARIPRMTDPSAWLACYPTMTPAELKRVEAGKFPRQVVEESDEDLAQLTKTLRGLGVTTHRPPAVDHSRSFSSPYWEADGYISYCPRDITLVAGSTLIEVASPMRSRYFELFNLRPLFQQYMLEGATWIAAPRPQLRDELYTRDEESRPLLGEAEPVFDAANVLRVGQDFFYQVSRSGNERGLDWLRSTLRLVDPTVRVHPLRDVYGYTHIDSTITVLRPGLVMLNPARIARDEVPEAFRGWDVLWCPEPRPTETALPYHLSEPWISMNLLMVNPELAIADSDQPELLRALEAKGISVLPHRLRHQRVLGGGFHCVTLDIARDGLREDYFG |
Consensus
[pKd Mean = 3.62] | - | 7006
(s=5842) | 20
(s=7) | MAACSLSPVVRWDVSEVGYDDCNIMADTRDGRYVVKIFHTSRSPALCARYVDVVRRVTEAGVAHPRLHRAEGSALLHHRPTGNRLMVMDRVEGITFLDADACPDDTELASVVEQTYRIHALDLYPEYVHDWWAIPQIATLAAEVAHLLTPGDQDRVAAAVETFGRLRVGTLPQVFSHGDLTKANLLRTPCGVPAVLDLAVSNRYARVHDLSMLAVNVLHGSPRPLPERVALLTGLYARHAPLTAAEHAALPGYVLAAAAMELLGAEREWSQGNRSEETRYLRELGRTTLRAAADWALVPALSTSRTRNRAPQDAPHTDERNPMTGPASPVNSWDEFTQLREIIVGDAAHARIPRMTDPSAWLACYPTMTPAELKRVEAGKFPRQVVEESDEDLAQLTKTLRGLGVTTHRPPAVDHSRSFSSPYWEADGYISYCPRDITLVAGSTLIEVASPMRSRYFELFNLRPLFQQYMLEGATWIAAPRPQLRDELYTRDEESRPLLGEAEPVFDAANVLRVGQDFFYQVSRSGNERGLDWLRSTLRLVDPTVRVHPLRDVYGYTHIDSTITVLRPGLVMLNPARIARDEVPEAFRGWDVLWCPEPRPTETALPYHLSEPWISMNLLMVNPELAIADSDQPELLRALEAKGISVLPHRLRHQRVLGGGFHCVTLDIARDGLREDYFG |