Ligand ID: CIA Drugbank ID: DB00820(Tadalafil) Indication:Used for the treatment of erectile dysfunction. |
DrReposER ID / Desc. | Hit PDBID |
Hit Macromolecule |
Res. Matches |
View | Interface | RMSD | Seq. Identity (%) |
HETATM | Dock | |
---|---|---|---|---|---|---|---|---|---|---|
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 1wnc | E2 GLYCOPROTEIN (SARSr-CoV) | 5 / 12 | ALA B 906ILE B 905GLN B 902ILE B1179GLN C 902 | 1.25A | 17.07 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 1wnc | E2 GLYCOPROTEIN (SARSr-CoV) | 5 / 12 | ALA B 906ILE B 905GLN B 902ILE B1179GLN C 902 | 1.33A | 16.20 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 1zv8 | E2 GLYCOPROTEIN (SARSr-CoV) | 5 / 12 | ALA G 6ILE G 5ILE L 31ALA K 12PHE I 9 | 1.44A | 15.34 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 2ahm | REPLICASEPOLYPROTEIN 1AB,HEAVY CHAINREPLICASEPOLYPROTEIN 1AB,LIGHT CHAIN (SARSr-CoV) | 5 / 12 | ALA G 115ILE G 111ILE C 73VAL C 71LEU C 22 | 1.32A | 19.14 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 2ahm | REPLICASEPOLYPROTEIN 1AB,HEAVY CHAINREPLICASEPOLYPROTEIN 1AB,LIGHT CHAIN (SARSr-CoV) | 5 / 12 | ALA G 115ILE G 111ILE C 73VAL C 71LEU C 22 | 1.29A | 19.40 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 2fe8 | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.31A | 22.31 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 2fe8 | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.24A | 23.04 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 2ozk | URIDYLATE-SPECIFICENDORIBONUCLEASE (SARSr-CoV) | 5 / 12 | ALA C 108ILE C 107ILE C 99VAL C 121ILE A 314 | 1.35A | 21.97 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 2rhb | URIDYLATE-SPECIFICENDORIBONUCLEASE (SARSr-CoV) | 5 / 11 | SER A 25ILE E 42VAL E 31ALA E 30ILE E 27 | 1.50A | 21.16 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 2rnk | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 6 / 12 | ALA A 590ILE A 592ILE A 593ALA A 631LEU A 546PHE A 581 | 1.79A | 17.27 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 3d0i | ACE2 (Pagumalarvata;Homosapiens;SARSr-CoV) | 5 / 12 | ALA B 576GLN B 524VAL B 573ILE B 407PHE B 400 | 1.36A | 21.50 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 3e9s | NSP3 (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.21A | 23.68 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 3e9s | NSP3 (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.26A | 21.80 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 3f9e | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 11 | SER A 10VAL A 157PHE A 150LEU A 115MET A 17 | 1.56A | 22.01 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 3mj5 | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.27A | 23.22 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 3sck | ACE2 (Pagumalarvata;Homosapiens;SARSr-CoV) | 5 / 12 | TYR A 381ALA A 384VAL A 404PHE A 525ILE A 544 | 1.36A | 21.68 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 4m0w | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.24A | 23.53 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 4m0w | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.31A | 21.70 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 4ovz | PAPAIN-LIKEPROTEINASE (SARS-COVUrbani) | 5 / 12 | ILE B 286ILE B 277PHE B 305LEU B 124GLN B 123 | 1.32A | 22.11 | NoneNoneNoneNoneDMS B 904 ( 4.4A) | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 4rna | PAPAIN-LIKE PROTEASE (Humanbetacoronavirus2cEMC/2012) | 5 / 11 | SER A 85ILE A 130LEU A 86ILE A 152MET A 153 | 1.66A | 20.80 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5c8s | GUANINE-N7METHYLTRANSFERASENSP10 (SARSr-CoV) | 5 / 11 | TYR D 64ILE D 201ALA C 18LEU D 7MET D 57 | 1.68A | 20.60 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5c8s | GUANINE-N7METHYLTRANSFERASE (SARSr-CoV) | 5 / 12 | ALA B 79ILE B 80ILE B 242VAL B 244PHE B 249 | 1.40A | 20.60 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5c8u | GUANINE-N7METHYLTRANSFERASE (SARSr-CoV) | 5 / 12 | ALA B 360ILE D 338VAL D 341ALA D 344LEU D 329 | 1.40A | 20.35 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5c8u | GUANINE-N7METHYLTRANSFERASENSP10 (SARSr-CoV) | 5 / 11 | TYR D 64ILE D 201ALA C 18LEU D 7MET D 57 | 1.65A | 20.35 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5e6j | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.24A | 22.99 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5e6j | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.30A | 21.76 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5f22 | NSP8NSP7 (SARSr-CoV) | 5 / 12 | ALA B 115ILE B 111ILE A 73VAL A 71LEU A 22 | 1.44A | 16.05 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5nfy | POLYPROTEIN 1AB (SARS-COVFrankfurt1) | 5 / 11 | TYR A 64ILE A 201ALA M 18LEU A 7MET A 57 | 1.64A | 20.35 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5nfy | POLYPROTEIN 1AB (SARS-COVFrankfurt1) | 5 / 12 | ALA C 79ILE C 242VAL C 244PHE C 249MET C 276 | 1.43A | 20.51 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5nfy | POLYPROTEIN 1AB (SARS-COVFrankfurt1) | 5 / 12 | ALA A 79ILE A 80ILE A 242VAL A 244PHE A 249 | 1.50A | 20.35 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5tl6 | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 12 | ILE B 286ILE B 277PHE B 305LEU B 124GLN B 123 | 1.23A | 23.22 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5tl6 | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 12 | ILE B 286ILE B 277PHE B 305LEU B 124GLN B 123 | 1.29A | 22.06 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5x58 | SPIKE GLYCOPROTEIN (SARS-COVBJ01) | 5 / 12 | ALA B 658ILE B 656ILE B 584VAL B 596PHE B 629 | 1.36A | 15.08 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5x58 | SPIKE GLYCOPROTEIN (SARS-COVBJ01) | 5 / 11 | ILE B 345VAL B 510ALA B 508LEU B 377PHE B 501 | 1.51A | 14.45 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5x5b | SPIKE GLYCOPROTEIN (SARS-COVBJ01) | 5 / 12 | ILE C 905GLN C 908VAL C1047PHE C1034PHE C 782 | 1.45A | 14.45 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5x5c | S PROTEIN (MERS-CoV) | 5 / 11 | VAL A 50ALA A 336LEU A 321ILE A 337PHE A 341 | 1.57A | 13.69 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5xlr | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 12 | ILE B 905VAL B1047PHE B1034ILE B 913PHE B 782 | 1.39A | 15.15 | ILE B 905 ( 0.7A)VAL B1047 ( 0.6A)PHE B1034 ( 1.3A)ILE B 913 ( 0.4A)PHE B 782 ( 1.3A) | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5xlr | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 11 | ILE A 702VAL A1047PHE A1034ILE A 913PHE A 782 | 1.48A | 14.35 | ILE A 702 ( 0.7A)VAL A1047 ( 0.6A)PHE A1034 ( 1.3A)ILE A 913 ( 0.4A)PHE A 782 ( 1.3A) | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5y3q | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.25A | 23.31 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5y3q | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 5 / 12 | ILE A 286ILE A 277PHE A 305LEU A 124GLN A 123 | 1.29A | 22.06 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 5zvm | PAN-COV INHIBITORYPEPTIDE EK1SPIKE GLYCOPROTEIN (SARSr-CoV;syntheticconstruct) | 5 / 12 | ALA A 906ILE A 905ILE a 37ALA B 912PHE C 909 | 1.47A | 15.21 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6acg | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 11 | ILE B 702VAL B1047PHE B1034ILE B 916PHE B 782 | 0.87A | 14.43 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6acg | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 12 | ILE B 702VAL B1047PHE B1034ILE B 916PHE B 782 | 1.01A | 15.15 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6acj | ACE2 (Homosapiens) | 5 / 12 | TYR D 381ALA D 384VAL D 404PHE D 525ILE D 544 | 1.38A | 21.46 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6ack | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 12 | ALA A 406ILE A 405ILE A 397VAL A 496ALA A 422 | 1.08A | 14.43 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6crv | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 5 / 12 | ALA C 658ILE C 650ILE C 674VAL C 594LEU C 286 | 1.43A | 14.40 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6crx | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 5 / 12 | ALA A 658ILE A 650ILE A 674VAL A 594LEU A 286 | 1.32A | 14.09 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6crx | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 5 / 12 | ILE C 905VAL C1047PHE C1034ILE C 913PHE C 782 | 1.38A | 15.10 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6cs1 | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 5 / 11 | ILE A 702VAL A1047PHE A1034ILE A 913PHE A 782 | 1.52A | 14.09 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6jyt | HELICASE (SARSr-CoV) | 5 / 12 | ILE B 545ILE B 512PHE B 561LEU B 581MET B 576 | 1.44A | 19.02 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6jyt | HELICASE (SARSr-CoV) | 5 / 11 | SER A 264ILE A 370ALA A 292PHE A 291ILE A 293 | 1.12A | 19.02 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6lzg | ACE2 (Homosapiens) | 5 / 12 | TYR A 381ALA A 384VAL A 404PHE A 525ILE A 544 | 1.41A | 21.44 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6m17 | ACE2 (Homosapiens) | 5 / 11 | SER D 646VAL B 647ALA B 650LEU D 642PHE B 715 | 1.44A | 17.49 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6m1d | SODIUM-DEPENDENTNEUTRAL AMINO ACIDTRANSPORTER B(0)AT1 (Homosapiens) | 5 / 12 | ALA A 406ILE A 407LEU A 234ILE A 236PHE A 420 | 1.11A | 19.94 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6m1d | SODIUM-DEPENDENTNEUTRAL AMINO ACIDTRANSPORTER B(0)AT1 (Homosapiens) | 5 / 11 | SER C 118ILE C 588VAL C 592ALA C 590PHE C 123 | 1.58A | 17.99 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6nb6 | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 12 | ALA B 658ILE B 650ILE B 674VAL B 594LEU B 286 | 1.40A | 13.58 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6nb6 | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 12 | ILE C 905VAL C1047PHE C1034ILE C 913PHE C 782 | 1.41A | 14.96 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6nb7 | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 11 | ILE B 702VAL B1047PHE B1034ILE B 913PHE B 880 | 1.52A | 13.58 | None | ||
![]() | 1XOZ_A_CIAA501_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6nur | NSP12NSP8 (SARSr-CoV) | 5 / 12 | TYR A 515ALA A 502ILE A 562LEU B 91MET A 380 | 1.41A | 16.56 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6nur | NSP7NSP8 (SARSr-CoV) | 5 / 11 | SER C 57VAL C 66ALA C 65GLN D 88PHE D 92 | 1.60A | 15.74 | None | ||
![]() | 1UDU_A_CIAA1003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6nus | NSP12 (SARSr-CoV) | 5 / 11 | SER A 672ALA A 379LEU A 673MET A 666PHE A 504 | 1.42A | 15.47 | None | ||
![]() | 1UDU_B_CIAB2003_1 (CGMP-SPECIFIC3',5'-CYCLICPHOSPHODIESTERASE) | 6ym0 | LIGHT CHAIN (Homosapiens) | 5 / 12 | ALA L 86ILE L 112VAL L 110LEU L 79PHE L 68 | 1.52A | None |