Ligand ID: 08H Drugbank ID: DB00404(Alprazolam) Indication:For the management of anxiety disorder or the short-term relief of symptoms of anxiety and for the treatment of panic disorder, with or without agoraphobia. |
DrReposER ID / Desc. | Hit PDBID |
Hit Macromolecule |
Res. Matches |
View | Interface | RMSD | Seq. Identity (%) |
HETATM | Dock | |
---|---|---|---|---|---|---|---|---|---|---|
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 1z1j | 3C-LIKE PROTEINASE (SARSr-CoV) | 4 / 8 | ASN B1151PHE B1008PHE B1294TYR B1154 | 1.43A | 20.7421.00 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2ahm | REPLICASEPOLYPROTEIN 1AB,HEAVY CHAINREPLICASEPOLYPROTEIN 1AB,LIGHT CHAIN (SARSr-CoV) | 4 / 7 | PRO G 121LEU C 61LEU G 108ILE G 125 | 1.35A | 17.96 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 2ajf | ACE2 (Homosapiens) | 4 / 8 | TYR B 237PHE B 592HIS B 239VAL B 604 | 1.41A | 20.9321.10 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2c3s | 3C-LIKE PROTEINASE (SARSr-CoV) | 4 / 7 | TRP A 207LEU A 268LEU A 272ILE A 286 | 1.54A | 17.97 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2d2d | 3C-LIKE PROTEINASE (SARSr-CoV) | 4 / 7 | TRP A 207LEU A 268LEU A 272ILE A 286 | 1.60A | 17.92 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 2ghw | SPIKE GLYCOPROTEIN (SARSr-CoV) | 4 / 8 | PHE C 501PHE C 325VAL C 349SER C 380 | 1.36A | 16.7020.09 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2ghw | ANTI-SCFV ANTIBODY,80R (Homosapiens) | 4 / 7 | TRP D 167LEU D 143LEU D 145ILE D 207 | 1.53A | 15.90 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2gib | NUCLEOCAPSID PROTEIN (SARSr-CoV) | 4 / 7 | LEU A 332LEU B 340ASN B 355ILE B 358 | 1.44A | 23.70 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2jw8 | NUCLEOCAPSID PROTEIN (SARSr-CoV) | 4 / 7 | LEU B 332LEU A 340ASN A 355ILE A 358 | 1.06A | 16.18 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2jzd | REPLICASEPOLYPROTEIN 1AB (SARSr-CoV) | 4 / 7 | LEU A 596LEU A 603ILE A 549MET A 551 | 1.56A | 18.79 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2kys | NSP7 (SARSr-CoV) | 4 / 7 | LEU A 61LEU A 62ASN A 71MET A 77 | 1.16A | 21.28 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2qc2 | 3C-LIKE PROTEINASE (-) | 4 / 7 | TRP B 207LEU B 268LEU B 272ILE B 286 | 1.58A | 17.92 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2rhb | URIDYLATE-SPECIFICENDORIBONUCLEASE (SARSr-CoV) | 4 / 7 | PRO F 157LEU F 189ASN F 74ILE F 71 | 1.55A | 14.01 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 2xyq | PUTATIVE 2'-O-METHYLTRANSFERASE (SARSr-CoV) | 4 / 7 | LEU A 54LEU A 59ASN A 210MET A 184 | 1.46A | 19.23 | None NA A1295 (-4.3A) NA A1295 (-4.3A)None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 3avz | 3C-LIKE PROTEINASE (SARSr-CoV) | 4 / 7 | TRP A 207LEU A 268LEU A 272ILE A 286 | 1.48A | 18.30 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 3d0h | ACE2 (Pagumalarvata;Homosapiens;SARSr-CoV) | 4 / 8 | TYR B 237PHE B 592HIS B 239VAL B 604 | 1.40A | 21.2521.44 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 3f9e | 3C-LIKE PROTEINASE (SARSr-CoV) | 4 / 7 | TRP A 207LEU A 268LEU A 272ILE A 286 | 1.57A | 17.92 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 3r24 | 2'-O-METHYLTRANSFERASE (SARSr-CoV) | 4 / 7 | LEU A 54LEU A 59ASN A 210MET A 184 | 1.46A | 18.15 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 3sci | ACE2 (Homosapiens) | 4 / 8 | TYR A 237PHE A 592HIS A 239VAL A 604 | 1.43A | 20.8921.02 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 3sck | ACE2 (Pagumalarvata;Homosapiens;SARSr-CoV) | 4 / 8 | TYR B 237PHE B 592HIS B 239VAL B 604 | 1.43A | 20.7821.36 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 4m0w | UBIQUITIN (Bostaurus) | 4 / 7 | LEU B 50LEU B 43ILE B 3MET B 1 | 1.42A | 19.38 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 4rna | PAPAIN-LIKE PROTEASE (Humanbetacoronavirus2cEMC/2012) | 4 / 7 | PRO A 45LEU A 54ASN A 50ILE A 4 | 1.24A | 16.30 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5c8s | GUANINE-N7METHYLTRANSFERASENSP10 (SARSr-CoV) | 4 / 7 | PRO D 24LEU C 14LEU D 7ILE D 55 | 1.39A | 13.33 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 5c8s | GUANINE-N7METHYLTRANSFERASE (SARSr-CoV) | 4 / 8 | TYR B 511PHE B 514PHE B 445VAL B 317 | 1.45A | 20.9920.73 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5c8t | GUANINE-N7METHYLTRANSFERASENSP10 (SARSr-CoV) | 4 / 7 | PRO D 24LEU C 14LEU D 7ILE D 55 | 1.38A | 14.71 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 5c8t | GUANINE-N7METHYLTRANSFERASE (SARSr-CoV) | 4 / 8 | TYR D 511PHE D 514PHE D 445VAL D 317 | 1.43A | 21.1620.50 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5c8t | NSP10 (SARSr-CoV) | 4 / 7 | PRO C 107LEU C 31ASN C 10ILE C 38 | 1.42A | 21.57 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5e6j | UBIQUITIN (syntheticconstruct) | 4 / 7 | LEU E 50LEU E 43ILE E 3MET E 1 | 1.44A | 19.38 | 5MW E 48 ( 4.2A)NoneNoneNone | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5e6j | POLYUBIQUITIN-B (syntheticconstruct) | 4 / 7 | LEU C 50LEU C 43ILE C 3MET C 1 | 1.48A | 19.23 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5f22 | NSP8NSP7 (SARSr-CoV) | 4 / 7 | PRO B 121LEU A 61LEU B 108ILE B 125 | 1.41A | 22.79 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5nfy | POLYPROTEIN 1AB (SARS-COVFrankfurt1) | 4 / 7 | PRO D 24LEU O 14LEU D 7ILE D 55 | 1.42A | 14.71 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5nfy | POLYPROTEIN 1AB (SARS-COVFrankfurt1) | 4 / 7 | PRO N 107LEU N 31ASN N 10ILE N 38 | 1.51A | 17.29 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 5nfy | POLYPROTEIN 1AB (SARS-COVFrankfurt1) | 4 / 8 | TYR B 511PHE B 514PHE B 445VAL B 317 | 1.41A | 20.9920.11 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5x4r | S PROTEIN (MERS-CoV) | 4 / 7 | TRP A 253LEU A 318LEU A 74ILE A 56 | 1.56A | 15.55 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 5x4r | S PROTEIN (MERS-CoV) | 4 / 8 | TYR A 58ASN A 277PHE A 75TYR A 71 | 1.31A | 20.7521.79 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 5x58 | SPIKE GLYCOPROTEIN (SARS-COVBJ01) | 4 / 8 | ASN C 479PHE C 483VAL C 337SER C 336 | 1.43A | 17.0916.86 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 5x5f | S PROTEIN (MERS-CoV) | 4 / 7 | PRO A 430LEU A 411LEU A 414ILE A 480 | 1.40A | 6.20 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 5x5f | S PROTEIN (MERS-CoV) | 4 / 8 | TYR A 58ASN A 277PHE A 75TYR A 71 | 1.05A | 17.5916.80 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6acg | SPIKE GLYCOPROTEIN (SARSr-CoV) | 4 / 7 | PRO C 586LEU C 283LEU C 286ILE C 584 | 1.50A | 6.85 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 6acg | SPIKE GLYCOPROTEIN (SARSr-CoV) | 4 / 8 | TYR A 356ASN A 375PHE A 379VAL A 369 | 1.38A | 17.8617.33 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 6crv | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 4 / 8 | ASN B 189PHE B 83PHE B 103VAL B 196 | 1.54A | 17.9317.06 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6crv | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 4 / 7 | TRP B 101LEU B 194LEU B 224ILE B 115 | 1.36A | 6.96 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6cs2 | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 4 / 7 | TRP A 101LEU A 170ASN A 119ILE A 117 | 1.59A | 6.72 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6cs2 | ACE2 (Homosapiens) | 4 / 7 | PRO D 415LEU D 439ASN D 290ILE D 291 | 1.11A | 11.98 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 6cs2 | SPIKEGLYCOPROTEIN,FIBRITIN (SARSr-CoV) | 4 / 8 | ASN A 189PHE A 83PHE A 103VAL A 196 | 1.52A | 17.5817.09 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6iex | MHC CLASS I ANTIGEN (Homosapiens;SARSr-CoV) | 4 / 7 | LEU C 5LEU C 8ASN A 70ILE A 66 | 1.41A | 5.98 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 6jyt | HELICASE (SARSr-CoV) | 4 / 8 | TYR B 457PHE B 437VAL B 449SER B 453 | 1.56A | 23.5521.36 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 6m18 | ACE2 (Homosapiens) | 4 / 8 | TYR D 237PHE D 592HIS D 239VAL D 604 | 1.39A | 20.8720.44 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6m18 | SODIUM-DEPENDENTNEUTRAL AMINO ACIDTRANSPORTER B(0)AT1 (Homosapiens) | 4 / 7 | LEU A 88ASN A 515ILE A 518MET A 521 | 1.47A | 11.41 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6m1d | ACE2 (Homosapiens) | 4 / 7 | PRO B 84LEU B 29ASN B 90ILE B 88 | 1.58A | 9.85 | None | ||
![]() | 6HUO_D_08HD501_0 (GAMMA-AMINOBUTYRICACID RECEPTORSUBUNITALPHA-1,GAMMA-AMINOBUTYRIC ACID RECEPTORSUBUNIT ALPHA-1GAMMA-AMINOBUTYRICACID RECEPTORSUBUNIT GAMMA-2) | 6nur | NSP12 (SARSr-CoV) | 4 / 8 | TYR A 619ASN A 695PHE A 753VAL A 785 | 1.54A | 19.6219.35 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6nur | NSP12NSP8 (SARSr-CoV) | 4 / 7 | PRO B 121LEU A 270LEU A 271ILE B 120 | 1.58A | 17.73 | None | ||
![]() | 3U5J_A_08HA1_1 (BROMODOMAIN-CONTAINING PROTEIN 4) | 6nus | NSP12 (SARSr-CoV) | 4 / 7 | TRP A 162LEU A 131LEU A 247ILE A 171 | 1.48A | 9.34 | None |