Ligand ID: TCI Drugbank ID: DB00470(Dronabinol) Indication:For the treatment of anorexia associated with weight loss in patients with AIDS, and nausea and vomiting associated with cancer chemotherapy in patients who have failed to respond adequately to conventional antiemetic treatments |
DrReposER ID / Desc. | Hit PDBID |
Hit Macromolecule |
Res. Matches |
View | Interface | RMSD | Seq. Identity (%) |
HETATM | Dock | |
---|---|---|---|---|---|---|---|---|---|---|
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 1z1j | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | LEU B1086TYR B1101GLY B1029VAL B1148GLY B1146 | 1.48A | 24.21 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 2a5k | 3C-LIKE PEPTIDASE (SARSr-CoV) | 5 / 10 | VAL A 148LEU A 115TYR A 101GLY A 29GLY A 120 | 1.48A | 23.82 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 2alv | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 10 | LEU A 86TYR A 101GLY A 29VAL A 148GLY A 146 | 1.57A | 23.57 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 2d2d | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | VAL B 148LEU B 115TYR B 101GLY B 29GLY B 120 | 1.34A | 23.53 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 2fe8 | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 4 / 5 | TYR B 137GLN B 122ILE B 286LEU B 119 | 1.68A | 21.85 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 2ghv | SPIKE GLYCOPROTEIN (SARSr-CoV) | 5 / 10 | VAL E 369LEU E 377SER E 370GLY E 368GLY E 418 | 1.57A | 19.91 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 2q6g | REPLICASEPOLYPROTEIN 1AB (SARS-COVBJ01) | 5 / 10 | LEU A 86TYR A 101GLY A 29VAL A 148GLY A 146 | 1.57A | 23.90 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 2qc2 | 3C-LIKE PROTEINASE (-) | 5 / 10 | VAL B 148LEU B 115TYR B 101GLY B 29GLY B 120 | 1.47A | 23.75 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 2qiq | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 5 / 10 | LEU A 86TYR A 101GLY A 29VAL A 148GLY A 146 | 1.57A | 23.90 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 2vj1 | MAIN PROTEINASE (SARSr-CoV) | 5 / 10 | VAL B 148LEU B 115TYR B 101GLY B 29GLY B 120 | 1.51A | 23.17 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 2xyr | NSP10PUTATIVE 2'-O-METHYLTRANSFERASE (SARSr-CoV) | 4 / 5 | GLN A 52ILE A 40LEU B 45PHE A 250 | 1.73A | 20.93 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 3aw1 | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | VAL A 148LEU A 115TYR A 101GLY A 29GLY A 120 | 1.51A | 23.90 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 3d0h | ACE2 (Pagumalarvata;Homosapiens;SARSr-CoV) | 4 / 5 | GLN B 442ILE B 407LEU B 410PHE B 438 | 1.39A | 16.75 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 3d62 | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | VAL A 148LEU A 115TYR A 101GLY A 29GLY A 120 | 1.45A | 24.05 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 3e9s | NSP3 (SARSr-CoV) | 4 / 5 | TYR A 137GLN A 122ILE A 286LEU A 119 | 1.68A | 20.66 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 3ea7 | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | VAL B 148LEU B 115TYR B 101GLY B 29GLY B 120 | 1.48A | 23.73 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 3ea9 | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | VAL A 148LEU A 115TYR A 101GLY A 29GLY A 120 | 1.48A | 23.73 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 3iwm | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | VAL C 148LEU C 115TYR C 101GLY C 29GLY C 120 | 1.46A | 23.90 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 3m3t | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | LEU A 86TYR A 101GLY A 29VAL A 148GLY A 146 | 1.57A | 23.96 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 3m3v | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | LEU A 86TYR A 101GLY A 29VAL A 148GLY A 146 | 1.61A | 23.58 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 3r24 | 2'-O-METHYLTRANSFERASENSP10 AND NSP11 (SARSr-CoV) | 4 / 5 | GLN A 52ILE A 40LEU B 45PHE A 250 | 1.74A | 20.45 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 3scl | ACE2 (Pagumalarvata;Homosapiens;SARSr-CoV) | 4 / 5 | GLN B 442ILE B 407LEU B 410PHE B 438 | 1.56A | 16.58 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 3sna | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | LEU A 86TYR A 101GLY A 29VAL A 148GLY A 146 | 1.57A | 23.90 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 4hi3 | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | VAL A 148LEU A 115TYR A 101GLY A 29GLY A 120 | 1.45A | 22.81 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 4m0w | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 4 / 5 | TYR A 137GLN A 122ILE A 286LEU A 119 | 1.68A | 20.12 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 4ovz | PAPAIN-LIKEPROTEINASE (SARS-COVUrbani) | 4 / 5 | TYR A 137GLN A 122ILE A 286LEU A 119 | 1.61A | 20.78 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 5b6o | 3C-LIKE PROTEINASE (SARSr-CoV) | 5 / 10 | LEU A 86TYR A 101GLY A 29VAL A 148GLY A 146 | 1.57A | 24.61 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 5e6j | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 4 / 5 | TYR A 137GLN A 122ILE A 286LEU A 119 | 1.66A | 19.94 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 5tl6 | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 4 / 5 | TYR B 137GLN B 122ILE B 286LEU B 119 | 1.65A | 20.60 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 5x5b | SPIKE GLYCOPROTEIN (SARS-COVBJ01) | 4 / 5 | TYR C 383ILE A 116LEU A 222PHE A 193 | 1.61A | 11.06 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 5x5f | S PROTEIN (MERS-CoV) | 5 / 10 | VAL A 958LEU A 964SER A 954GLY A 959VAL A1107 | 1.43A | 11.29 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 5y3q | REPLICASEPOLYPROTEIN 1A (SARSr-CoV) | 4 / 5 | TYR A 137GLN A 122ILE A 286LEU A 119 | 1.69A | 19.41 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6acj | SPIKE GLYCOPROTEIN (SARSr-CoV) | 4 / 5 | TYR A 899GLN A 895ILE B1086PHE B1071 | 1.42A | 11.33 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6ack | ACE2 (Homosapiens) | 4 / 5 | GLN D 442ILE D 407LEU D 410PHE D 438 | 1.52A | 16.42 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6crv | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 4 / 5 | TYR C 42GLN B 546ILE B 570PHE B 548 | 1.52A | 11.56 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6cs1 | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 4 / 5 | TYR A 42GLN C 546ILE C 570PHE C 548 | 1.28A | 11.56 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6m17 | ACE2 (Homosapiens) | 4 / 5 | GLN B 442ILE B 407LEU B 410PHE B 438 | 1.67A | 15.80 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6m1d | SODIUM-DEPENDENTNEUTRAL AMINO ACIDTRANSPORTER B(0)AT1 (Homosapiens) | 4 / 5 | GLN A 63ILE A 319LEU A 254PHE A 253 | 1.47A | 15.79 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 6m1d | SODIUM-DEPENDENTNEUTRAL AMINO ACIDTRANSPORTER B(0)AT1 (Homosapiens) | 5 / 10 | VAL C 441LEU C 286SER C 288GLY C 438GLY C 434 | 1.55A | 16.88 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6nb6 | SPIKE GLYCOPROTEIN (SARSr-CoV) | 4 / 5 | TYR C 42GLN A 546ILE A 570PHE A 548 | 1.41A | 11.56 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6nur | NSP12 (SARSr-CoV) | 4 / 5 | TYR A 619GLN A 698LEU A 630PHE A 694 | 1.59A | 12.85 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6vw1 | ACE2 (Homosapiens) | 4 / 5 | GLN B 442ILE B 407LEU B 410PHE B 438 | 1.57A | 16.58 | None | ||
![]() | 3LS4_H_TCIH220_1 (HEAVY CHAIN OFANTIBODY FABFRAGMENT) | 6w41 | CR3022 FAB HEAVYCHAINCR3022 FAB LIGHTCHAIN (Homosapiens) | 5 / 10 | VAL H 163VAL H 181LEU L 135SER H 180GLY H 162 | 1.71A | 54.38 | None | ||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6yla | HEAVY CHAINLIGHT CHAIN (Homosapiens) | 4 / 5 | TYR C 42GLN C 95ILE B 102PHE C 104 | 1.76A | None | |||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6yla | HEAVY CHAINLIGHT CHAIN (Homosapiens) | 4 / 5 | TYR L 42GLN L 95ILE H 102PHE L 104 | 1.79A | None | |||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6ym0 | HEAVY CHAINLIGHT CHAIN (Homosapiens) | 4 / 5 | TYR L 42GLN L 95ILE H 102PHE L 104 | 1.72A | None | |||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6yor | IGG H CHAINIGG L CHAIN (Homosapiens) | 4 / 5 | TYR L 42GLN L 95ILE H 102PHE L 104 | 1.78A | None | |||
![]() | 3LS4_H_TCIH220_2 (HEAVY CHAIN OFANTIBODY FABFRAGMENTLIGHT CHAIN OFANTIBODY FABFRAGMENT) | 6yor | IGG H CHAINIGG L CHAIN (Homosapiens) | 4 / 5 | TYR C 42GLN C 95ILE B 102PHE C 104 | 1.79A | None |