SIMILAR PATTERNS OF AMINO ACIDS FOR 3HBB_A_TMQA611
List of similar pattern of amino acids derived from ASSAM searchHit | Macromolecule/ Organism |
Pfam | Res. | Interface | HETATM | RMSD | Dali Z-score | Seq. Identity (%) | View | Dock | |
---|---|---|---|---|---|---|---|---|---|---|---|
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1b0k | PROTEIN (ACONITASE) (Sus scrofa) |
PF00330(Aconitase)PF00694(Aconitase_C) | 5 | VAL A 632ALA A 658ILE A 699ILE A 715ILE A 633 | None | 1.14A | 3hbbA-1b0kA:undetectable | 3hbbA-1b0kA:21.52 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1bev | BOVINE ENTEROVIRUSCOAT PROTEINS VP1 TOVP4 (Enterovirus E) |
PF00073(Rhv) | 5 | VAL 2 211ILE 2 127PRO 2 128LEU 2 158ILE 2 209 | None | 0.78A | 3hbbA-1bev2:undetectable | 3hbbA-1bev2:18.18 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1cz3 | DIHYDROFOLATEREDUCTASE (Thermotogamaritima) |
PF00186(DHFR_1) | 6 | VAL A 6ALA A 8ASP A 27ILE A 51LEU A 55ILE A 100 | None | 0.67A | 3hbbA-1cz3A:18.1 | 3hbbA-1cz3A:16.50 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1dr6 | DIHYDROFOLATEREDUCTASE (Gallus gallus) |
PF00186(DHFR_1) | 5 | ALA A 9ILE A 60PRO A 61LEU A 67TYR A 121 | HBI A 198 ( 3.6A)NoneNoneNoneNone | 0.50A | 3hbbA-1dr6A:22.6 | 3hbbA-1dr6A:17.37 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1ehy | PROTEIN (SOLUBLEEPOXIDE HYDROLASE) (Agrobacteriumtumefaciens) |
PF00561(Abhydrolase_1) | 5 | ILE A 133ILE A 111LEU A 225ILE A 219TYR A 152 | None | 1.10A | 3hbbA-1ehyA:undetectable | 3hbbA-1ehyA:19.62 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1mky | PROBABLE GTP-BINDINGPROTEIN ENGA (Thermotogamaritima) |
PF01926(MMR_HSR1)PF14714(KH_dom-like) | 5 | VAL A 208ALA A 206ILE A 346ILE A 185LEU A 238 | None | 0.96A | 3hbbA-1mkyA:2.9 | 3hbbA-1mkyA:22.37 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1u70 | DIHYDROFOLATEREDUCTASE (Mus musculus) |
PF00186(DHFR_1) | 5 | ALA A 9ILE A 60PRO A 61LEU A 67TYR A 121 | NDP A 188 (-3.6A)MTX A 187 ( 4.2A)MTX A 187 (-4.8A)MTX A 187 ( 4.5A)None | 0.55A | 3hbbA-1u70A:22.3 | 3hbbA-1u70A:18.55 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1u71 | DIHYDROFOLATEREDUCTASE (Homo sapiens) |
PF00186(DHFR_1) | 5 | ALA A 9ILE A 60PRO A 61LEU A 67TYR A 121 | MXA A 187 (-3.6A)MXA A 187 ( 4.7A)MXA A 187 (-4.4A)NoneNone | 0.69A | 3hbbA-1u71A:21.9 | 3hbbA-1u71A:18.38 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1zcz | BIFUNCTIONAL PURINEBIOSYNTHESIS PROTEINPURH (Thermotogamaritima) |
PF01808(AICARFT_IMPCHas)PF02142(MGS) | 5 | ALA A 45ILE A 43ILE A 17LEU A 120ILE A 4 | None | 1.01A | 3hbbA-1zczA:undetectable | 3hbbA-1zczA:22.95 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1zdr | DIHYDROFOLATEREDUCTASE (Geobacillusstearothermophilus) |
PF00186(DHFR_1) | 5 | ALA A 7ASP A 27ILE A 50LEU A 54ILE A 96 | NoneNoneSO4 A3486 ( 4.8A)SO4 A3486 (-4.2A)None | 0.72A | 3hbbA-1zdrA:18.8 | 3hbbA-1zdrA:17.08 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2ap1 | PUTATIVE REGULATORPROTEIN (Salmonellaenterica) |
PF00480(ROK) | 5 | ALA A 42ILE A 12ILE A 64PRO A 65LEU A 75 | None | 0.86A | 3hbbA-2ap1A:undetectable | 3hbbA-2ap1A:20.87 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2blb | DIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Plasmodiumvivax) |
PF00186(DHFR_1) | 7 | ALA A 15ASP A 53ILE A 121PRO A 122LEU A 128ILE A 173TYR A 179 | CP7 A1240 (-3.7A)CP7 A1240 (-3.1A)MES A1241 ( 4.1A)NoneMES A1241 (-4.5A)CP7 A1240 ( 3.8A)None | 0.52A | 3hbbA-2blbA:20.7 | 3hbbA-2blbA:17.94 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2blb | DIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Plasmodiumvivax) |
PF00186(DHFR_1) | 6 | ASP A 53MET A 54ILE A 121PRO A 122LEU A 128ILE A 173 | CP7 A1240 (-3.1A)MES A1241 (-3.6A)MES A1241 ( 4.1A)NoneMES A1241 (-4.5A)CP7 A1240 ( 3.8A) | 0.72A | 3hbbA-2blbA:20.7 | 3hbbA-2blbA:17.94 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2deo | 441AA LONGHYPOTHETICAL NFEDPROTEIN (Pyrococcushorikoshii) |
PF00574(CLP_protease) | 5 | VAL A 24ALA A 48ILE A 45ILE A 86ILE A 57 | None | 1.12A | 3hbbA-2deoA:undetectable | 3hbbA-2deoA:18.51 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2gu2 | ASPA PROTEIN (Rattusnorvegicus) |
PF04952(AstE_AspA) | 5 | VAL A 178ILE A 15PRO A 49LEU A 198ILE A 176 | None | 0.92A | 3hbbA-2gu2A:undetectable | 3hbbA-2gu2A:20.31 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2h2q | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Trypanosomacruzi) |
PF00186(DHFR_1)PF00303(Thymidylat_synt) | 5 | ALA A 28ILE A 41ASP A 48MET A 49PRO A 85 | NAP A 523 (-3.7A)NAP A 523 (-4.4A)NoneNoneNone | 0.91A | 3hbbA-2h2qA:51.0 | 3hbbA-2h2qA:100.00 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2h2q | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Trypanosomacruzi) |
PF00186(DHFR_1)PF00303(Thymidylat_synt) | 9 | VAL A 26ALA A 28ILE A 41ASP A 48ILE A 84PRO A 85LEU A 91ILE A 154TYR A 160 | NoneNAP A 523 (-3.7A)NAP A 523 (-4.4A)NoneNoneNoneNoneNoneNone | 0.54A | 3hbbA-2h2qA:51.0 | 3hbbA-2h2qA:100.00 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2in2 | PICORNAIN 3C (Rhinovirus B) |
PF00548(Peptidase_C3) | 5 | VAL A 34ILE A 18ILE A 159LEU A 173ILE A 30 | None | 1.04A | 3hbbA-2in2A:undetectable | 3hbbA-2in2A:16.96 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2jn4 | HYPOTHETICAL PROTEINFIXU, NIFT (Rhodopseudomonaspalustris) |
PF06988(NifT) | 5 | VAL A 61ALA A 63ILE A 25LEU A 33ILE A 5 | None | 1.08A | 3hbbA-2jn4A:undetectable | 3hbbA-2jn4A:8.86 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2oip | CHAIN A, CRYSTALSTRUCTURE OF DHFR (Cryptosporidiumhominis) |
PF00186(DHFR_1)PF00303(Thymidylat_synt) | 6 | VAL A 9ALA A 11ASP A 32ILE A 62LEU A 67TYR A 119 | MTX A 605 ( 4.0A)MTX A 605 ( 3.6A)MTX A 605 ( 3.0A)MTX A 605 ( 4.6A)MTX A 605 ( 4.4A)None | 0.54A | 3hbbA-2oipA:18.1 | 3hbbA-2oipA:42.41 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2qkc | SUPEROXIDE DISMUTASE[MN] (Homo sapiens) |
PF00081(Sod_Fe_N)PF02777(Sod_Fe_C) | 5 | VAL A 160ALA A 164ILE A 18ILE A 184LEU A 156 | None MN A 199 ( 4.9A)NoneNoneNone | 1.14A | 3hbbA-2qkcA:undetectable | 3hbbA-2qkcA:17.65 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2vvx | PROTEIN A52 (Vaccinia virus) |
PF06227(Poxvirus) | 5 | VAL A 131ILE A 164ILE A 83LEU A 180ILE A 135 | None | 1.12A | 3hbbA-2vvxA:undetectable | 3hbbA-2vvxA:14.23 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2w3w | DIHYDROFOLATEREDUCTASE (Mycobacteriumavium) |
PF00186(DHFR_1) | 5 | ASP A 31PRO A 55LEU A 61ILE A 102TYR A 108 | VG9 A1168 (-3.0A)VG9 A1168 ( 4.6A)VG9 A1168 ( 4.4A)VG9 A1168 ( 4.2A)None | 0.79A | 3hbbA-2w3wA:20.8 | 3hbbA-2w3wA:19.96 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2w3w | DIHYDROFOLATEREDUCTASE (Mycobacteriumavium) |
PF00186(DHFR_1) | 7 | VAL A 9ALA A 11ILE A 24ASP A 31LEU A 61ILE A 102TYR A 108 | VG9 A1168 (-4.2A)VG9 A1168 ( 3.8A)NDP A1169 ( 4.4A)VG9 A1168 (-3.0A)VG9 A1168 ( 4.4A)VG9 A1168 ( 4.2A)None | 0.49A | 3hbbA-2w3wA:20.8 | 3hbbA-2w3wA:19.96 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2w9s | DIHYDROFOLATEREDUCTASE TYPE 1FROM TN4003 (Staphylococcusaureus) |
PF00186(DHFR_1) | 5 | ALA A 7ASP A 27ILE A 50LEU A 54TYR A 98 | TOP A1160 ( 3.6A)TOP A1160 (-2.8A)TOP A1160 (-4.4A)NoneNone | 0.53A | 3hbbA-2w9sA:19.4 | 3hbbA-2w9sA:16.02 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2wli | POTASSIUM CHANNEL (Magnetospirillummagnetotacticum) |
PF01007(IRK) | 5 | ALA A 259ILE A 224PRO A 223LEU A 232ILE A 265 | None | 1.09A | 3hbbA-2wliA:undetectable | 3hbbA-2wliA:21.50 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2xfg | ENDOGLUCANASE 1 (Ruminiclostridiumthermocellum) |
PF00942(CBM_3) | 5 | VAL B 470ALA B 468ILE B 599ILE B 504ILE B 478 | None | 1.14A | 3hbbA-2xfgB:undetectable | 3hbbA-2xfgB:14.94 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2zai | OLIGOSACCHARYLTRANSFERASE STT3SUBUNIT RELATEDPROTEIN (Pyrococcusfuriosus) |
no annotation | 5 | ALA A 786ILE A 799ILE A 732LEU A 746ILE A 771 | None | 1.04A | 3hbbA-2zaiA:undetectable | 3hbbA-2zaiA:22.69 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3aeq | LIGHT-INDEPENDENTPROTOCHLOROPHYLLIDEREDUCTASE SUBUNIT B (Rhodobactercapsulatus) |
PF00148(Oxidored_nitro) | 5 | ALA B 375ILE B 237PRO B 236LEU B 398ILE B 373 | None | 0.97A | 3hbbA-3aeqB:undetectable | 3hbbA-3aeqB:23.50 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3b9p | CG5977-PA, ISOFORM A (Drosophilamelanogaster) |
PF00004(AAA)PF09336(Vps4_C) | 5 | ALA A 542MET A 574ILE A 473LEU A 567ILE A 579 | None | 1.13A | 3hbbA-3b9pA:undetectable | 3hbbA-3b9pA:22.80 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3dg8 | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Plasmodiumfalciparum) |
PF00186(DHFR_1) | 6 | ALA A 16ASP A 54ILE A 112PRO A 113LEU A 119TYR A 170 | RJ6 A 609 (-3.7A)RJ6 A 609 (-3.0A)RJ6 A 609 (-4.8A)NoneRJ6 A 609 (-4.4A)NDP A 610 ( 4.9A) | 0.46A | 3hbbA-3dg8A:21.1 | 3hbbA-3dg8A:22.34 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3dg8 | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Plasmodiumfalciparum) |
PF00186(DHFR_1) | 5 | ASP A 54MET A 55ILE A 112PRO A 113LEU A 119 | RJ6 A 609 (-3.0A)NoneRJ6 A 609 (-4.8A)NoneRJ6 A 609 (-4.4A) | 0.91A | 3hbbA-3dg8A:21.1 | 3hbbA-3dg8A:22.34 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3e13 | PUTATIVE IRON-UPTAKEABC TRANSPORTSYSTEM,PERIPLASMICIRON-BINDING PROTEIN (Campylobacterjejuni) |
PF13343(SBP_bac_6) | 5 | ALA X 194ILE X 137ILE X 225PRO X 227ILE X 117 | None | 1.12A | 3hbbA-3e13X:undetectable | 3hbbA-3e13X:21.84 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3h3z | CYCLICNUCLEOTIDE-BINDINGPROTEIN (Ruegeriapomeroyi) |
PF00027(cNMP_binding)PF13545(HTH_Crp_2) | 5 | VAL A 113ILE A 128ILE A 16LEU A 28ILE A 109 | None | 0.99A | 3hbbA-3h3zA:undetectable | 3hbbA-3h3zA:21.15 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3hba | PUTATIVEPHOSPHOSUGARISOMERASE (Shewanelladenitrificans) |
PF01380(SIS) | 5 | ALA A 109ILE A 130ILE A 138PRO A 139ILE A 94 | None | 1.11A | 3hbbA-3hbaA:undetectable | 3hbbA-3hbaA:22.54 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3i8a | DIHYDROFOLATEREDUCTASE (Staphylococcusaureus) |
PF00186(DHFR_1) | 5 | ALA X 7ASP X 27ILE X 50LEU X 54TYR X 98 | N22 X 219 ( 3.6A)N22 X 219 (-2.8A)N22 X 219 (-4.6A)NoneNone | 0.69A | 3hbbA-3i8aX:19.3 | 3hbbA-3i8aX:15.16 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3ia4 | DIHYDROFOLATEREDUCTASE (Moritellaprofunda) |
PF00186(DHFR_1) | 5 | ALA A 8ILE A 51LEU A 55ILE A 96TYR A 102 | MTX A 164 ( 3.7A)MTX A 164 (-4.1A)MTX A 164 ( 4.4A)MTX A 164 ( 4.2A)None | 0.71A | 3hbbA-3ia4A:19.5 | 3hbbA-3ia4A:17.43 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3j7a | 40S RIBOSOMALPROTEIN US19 (Plasmodiumfalciparum) |
PF00203(Ribosomal_S19) | 5 | ILE X 34ILE X 86PRO X 87LEU X 57ILE X 49 | None | 1.06A | 3hbbA-3j7aX:undetectable | 3hbbA-3j7aX:15.48 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3kjr | DIHYDROFOLATEREDUCTASE/THYMIDYLATE SYNTHASE (Babesia bovis) |
PF00186(DHFR_1)PF00303(Thymidylat_synt) | 7 | ALA A 16ILE A 29ASP A 37ILE A 73PRO A 74LEU A 80TYR A 129 | NAP A 512 (-3.7A)NAP A 512 (-4.5A)NoneNoneNoneNoneNone | 0.63A | 3hbbA-3kjrA:12.7 | 3hbbA-3kjrA:39.70 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3lnl | UPF0135 PROTEINSA1388 (Staphylococcusaureus) |
PF01784(NIF3) | 5 | VAL A 304ALA A 297ILE A 128ILE A 125ILE A 283 | None | 1.03A | 3hbbA-3lnlA:undetectable | 3hbbA-3lnlA:21.21 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3mgz | 3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATESYNTHASE (Mycobacteriumtuberculosis) |
PF00926(DHBP_synthase) | 5 | ALA A 147ILE A 163ILE A 166LEU A 181ILE A 23 | None | 1.05A | 3hbbA-3mgzA:undetectable | 3hbbA-3mgzA:19.15 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3mm5 | SULFITE REDUCTASE,DISSIMILATORY-TYPESUBUNIT ALPHA (Archaeoglobusfulgidus) |
PF01077(NIR_SIR)PF03460(NIR_SIR_ferr) | 5 | VAL A 331ILE A 214PRO A 172LEU A 344ILE A 309 | None | 1.14A | 3hbbA-3mm5A:undetectable | 3hbbA-3mm5A:20.63 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3ppo | GLYCINEBETAINE/CARNITINE/CHOLINE-BINDINGPROTEIN (Bacillussubtilis) |
PF04069(OpuAC) | 5 | ALA A 64ILE A 247PRO A 248LEU A 258ILE A 55 | None | 1.14A | 3hbbA-3ppoA:undetectable | 3hbbA-3ppoA:21.47 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3pv2 | DEGQ (Legionellafallonii) |
PF13180(PDZ_2)PF13365(Trypsin_2) | 5 | ALA A 305ILE A 302ILE A 323LEU A 288ILE A 250 | None | 1.09A | 3hbbA-3pv2A:undetectable | 3hbbA-3pv2A:22.32 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3rg9 | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Trypanosomabrucei) |
PF00186(DHFR_1) | 6 | ALA A 34ASP A 54MET A 55LEU A 90ILE A 160TYR A 166 | WRA A 602 (-3.9A)WRA A 602 (-2.9A)WRA A 602 (-3.7A)WRA A 602 (-4.8A)WRA A 602 ( 3.9A)None | 1.47A | 3hbbA-3rg9A:32.3 | 3hbbA-3rg9A:60.00 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3rg9 | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Trypanosomabrucei) |
PF00186(DHFR_1) | 9 | VAL A 32ALA A 34ILE A 47ASP A 54MET A 55PRO A 91LEU A 97ILE A 160TYR A 166 | WRA A 602 (-4.3A)WRA A 602 (-3.9A)WRA A 602 ( 4.5A)WRA A 602 (-2.9A)WRA A 602 (-3.7A)WRA A 602 (-4.3A)NoneWRA A 602 ( 3.9A)None | 0.54A | 3hbbA-3rg9A:32.3 | 3hbbA-3rg9A:60.00 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3ruc | WBGU (Plesiomonasshigelloides) |
PF01370(Epimerase) | 5 | ALA A 264ILE A 211PRO A 212LEU A 274ILE A 325 | None | 0.81A | 3hbbA-3rucA:undetectable | 3hbbA-3rucA:20.93 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3shw | TIGHT JUNCTIONPROTEIN ZO-1 (Homo sapiens) |
PF00595(PDZ)PF00625(Guanylate_kin)PF07653(SH3_2) | 5 | ALA A 785ILE A 773ILE A 653PRO A 652LEU A 743 | None | 1.06A | 3hbbA-3shwA:undetectable | 3hbbA-3shwA:21.89 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3sl1 | ARGINASE (Plasmodiumfalciparum) |
PF00491(Arginase) | 5 | VAL A 361ILE A 310ILE A 268LEU A 351ILE A 320 | None | 0.94A | 3hbbA-3sl1A:undetectable | 3hbbA-3sl1A:21.65 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3thw | DNA MISMATCH REPAIRPROTEIN MSH3 (Homo sapiens) |
PF00488(MutS_V)PF01624(MutS_I)PF05188(MutS_II)PF05192(MutS_III) | 5 | ALA B 918ILE B 920ILE B 909PRO B 574LEU B 555 | None | 1.13A | 3hbbA-3thwB:undetectable | 3hbbA-3thwB:19.98 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3ti7 | BASIC EXTRACELLULARSUBTILISIN-LIKEPROTEASE BPRV (Dichelobacternodosus) |
PF00082(Peptidase_S8) | 5 | VAL A 109ALA A 280ILE A 203ILE A 148LEU A 138 | None | 1.08A | 3hbbA-3ti7A:undetectable | 3hbbA-3ti7A:19.59 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3tq9 | DIHYDROFOLATEREDUCTASE (Coxiellaburnetii) |
PF00186(DHFR_1) | 5 | ALA A 8ASP A 28ILE A 51LEU A 55ILE A 96 | MTX A2001 ( 3.4A)MTX A2001 (-2.7A)MTX A2001 (-4.3A)MTX A2001 ( 4.5A)MTX A2001 ( 4.2A) | 0.55A | 3hbbA-3tq9A:19.7 | 3hbbA-3tq9A:19.32 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3um6 | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Plasmodiumfalciparum) |
PF00186(DHFR_1)PF00303(Thymidylat_synt) | 7 | ASP A 54MET A 55ILE A 112PRO A 113LEU A 119ILE A 164TYR A 170 | 1CY A 609 (-2.9A)1CY A 609 ( 3.7A)1CY A 609 (-4.4A)NoneNone1CY A 609 ( 4.0A)None | 0.69A | 3hbbA-3um6A:19.3 | 3hbbA-3um6A:37.99 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3vco | DIHYDROFOLATEREDUCTASE (Schistosomamansoni) |
PF00186(DHFR_1) | 6 | ALA A 8ILE A 57PRO A 58LEU A 64ILE A 111TYR A 117 | None | 0.75A | 3hbbA-3vcoA:3.3 | 3hbbA-3vcoA:19.54 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3vco | DIHYDROFOLATEREDUCTASE (Schistosomamansoni) |
PF00186(DHFR_1) | 8 | VAL A 6ALA A 8ASP A 28MET A 29ILE A 57LEU A 64ILE A 111TYR A 117 | None | 0.73A | 3hbbA-3vcoA:3.3 | 3hbbA-3vcoA:19.54 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 3vth | HYDROGENASEMATURATION FACTOR (Caldanaerobactersubterraneus) |
PF00708(Acylphosphatase)PF01300(Sua5_yciO_yrdC)PF07503(zf-HYPF) | 5 | ALA A 237ILE A 217ILE A 220LEU A 317ILE A 325 | None | 0.98A | 3hbbA-3vthA:undetectable | 3hbbA-3vthA:21.20 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4ds1 | DYNEIN LIGHT CHAIN1, CYTOPLASMIC (Saccharomycescerevisiae) |
PF01221(Dynein_light) | 5 | ILE A 24ILE A 81PRO A 9LEU A 32ILE A 41 | None | 1.09A | 3hbbA-4ds1A:undetectable | 3hbbA-4ds1A:11.54 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4emy | AMINOTRANSFERASECLASS I AND II (Anaerococcusprevotii) |
PF00155(Aminotran_1_2) | 5 | ALA A 24ILE A 20ILE A 384LEU A 403ILE A 375 | None | 1.10A | 3hbbA-4emyA:2.2 | 3hbbA-4emyA:21.54 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4f6o | METACASPASE-1 (Saccharomycescerevisiae) |
PF00656(Peptidase_C14) | 5 | ALA A 199ILE A 141ILE A 162LEU A 166ILE A 177 | None | 1.09A | 3hbbA-4f6oA:undetectable | 3hbbA-4f6oA:20.62 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4g1j | SORTASE FAMILYPROTEIN (Streptococcusagalactiae) |
PF04203(Sortase) | 5 | ALA A 158ILE A 186ILE A 119PRO A 120LEU A 175 | None | 1.07A | 3hbbA-4g1jA:undetectable | 3hbbA-4g1jA:19.14 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4g76 | PHOSPHODIESTERASE (Pseudomonasaeruginosa) |
PF14859(Colicin_M) | 5 | ALA A 146ASP A 96ILE A 279PRO A 280LEU A 166 | None | 1.05A | 3hbbA-4g76A:undetectable | 3hbbA-4g76A:19.37 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4g8z | DIHYDROFOLATEREDUCTASE (Pneumocystisjirovecii) |
PF00186(DHFR_1) | 6 | ALA X 12ILE X 65PRO X 66LEU X 72ILE X 123TYR X 129 | NDP X 302 ( 3.8A)TOP X 301 ( 4.3A)TOP X 301 (-4.8A)NoneTOP X 301 ( 4.0A)None | 0.50A | 3hbbA-4g8zX:21.9 | 3hbbA-4g8zX:17.32 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4gip | FUSION GLYCOPROTEINF1FUSION GLYCOPROTEINF2 (Mammalianrubulavirus 5) |
PF00523(Fusion_gly) | 5 | VAL D 175ILE D 180ILE A 69LEU D 196ILE D 172 | None | 1.06A | 3hbbA-4gipD:undetectable | 3hbbA-4gipD:20.78 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4h7l | UNCHARACTERIZEDPROTEIN (Planctopiruslimnophila) |
no annotation | 5 | VAL A 104ALA A 107ILE A 109ILE A 95LEU A 80 | None | 1.11A | 3hbbA-4h7lA:undetectable | 3hbbA-4h7lA:14.29 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4h96 | DIHYDROFOLATEREDUCTASE (Candidaalbicans) |
PF00186(DHFR_1) | 6 | ALA A 11ILE A 62PRO A 63LEU A 69ILE A 112TYR A 118 | 14Q A 202 ( 3.7A)14Q A 202 ( 4.8A)NoneNone14Q A 202 ( 4.2A)None | 0.72A | 3hbbA-4h96A:19.1 | 3hbbA-4h96A:19.85 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4h98 | DIHYDROFOLATEREDUCTASE ([Candida]glabrata) |
PF00186(DHFR_1) | 7 | ALA A 11MET A 33ILE A 62PRO A 63LEU A 69ILE A 121TYR A 127 | 14Q A 302 ( 3.4A)14Q A 302 (-4.0A)14Q A 302 (-4.2A)14Q A 302 (-4.4A)None14Q A 302 ( 4.0A)None | 0.82A | 3hbbA-4h98A:19.7 | 3hbbA-4h98A:23.78 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4hgn | 2-KETO-3-DEOXY-D-MANNO-OCTULOSONATE8-PHOSPHATEPHOSPHOHYDROLASE (Bacteroidesthetaiotaomicron) |
PF08282(Hydrolase_3) | 5 | VAL A 21ALA A 130ILE A 141ILE A 4LEU A 106 | None | 1.04A | 3hbbA-4hgnA:2.7 | 3hbbA-4hgnA:15.11 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4i3u | ALDEHYDEDEHYDROGENASE (NAD+) (Sinorhizobiummeliloti) |
PF00171(Aldedh) | 5 | VAL A 164ALA A 153ILE A 151PRO A 62LEU A 202 | None | 1.14A | 3hbbA-4i3uA:undetectable | 3hbbA-4i3uA:23.53 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4m2x | DIHYDROFOLATEREDUCTASE (Mycobacteriumtuberculosis) |
PF00186(DHFR_1) | 6 | ALA A 7ILE A 20ASP A 27LEU A 57ILE A 94TYR A 100 | TMQ A 202 ( 3.5A)NDP A 201 (-4.0A)TMQ A 202 ( 2.7A)NoneTMQ A 202 ( 3.8A)None | 0.40A | 3hbbA-4m2xA:19.8 | 3hbbA-4m2xA:20.04 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4m2x | DIHYDROFOLATEREDUCTASE (Mycobacteriumtuberculosis) |
PF00186(DHFR_1) | 5 | ILE A 20PRO A 51LEU A 57ILE A 94TYR A 100 | NDP A 201 (-4.0A)TMQ A 202 (-4.2A)NoneTMQ A 202 ( 3.8A)None | 0.74A | 3hbbA-4m2xA:19.8 | 3hbbA-4m2xA:20.04 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4mbo | SERINE-RICH REPEATADHESIONGLYCOPROTEIN (SRR1) (Streptococcusagalactiae) |
PF10425(SdrG_C_C) | 5 | ASP A 574ILE A 599PRO A 600LEU A 606ILE A 522 | NoneNoneMLZ A 601 ( 3.7A)NoneNone | 1.02A | 3hbbA-4mboA:undetectable | 3hbbA-4mboA:20.49 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4n54 | INOSITOLDEHYDROGENASE (Lactobacilluscasei) |
PF01408(GFO_IDH_MocA)PF02894(GFO_IDH_MocA_C) | 5 | ALA A 88ILE A 74ILE A 101PRO A 100ILE A 115 | None | 1.07A | 3hbbA-4n54A:undetectable | 3hbbA-4n54A:20.75 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4ntl | LIPOPROTEIN, YAECFAMILY (Enterococcusfaecalis) |
PF03180(Lipoprotein_9) | 5 | ALA A 151ILE A 148ILE A 135PRO A 136ILE A 155 | None | 1.03A | 3hbbA-4ntlA:undetectable | 3hbbA-4ntlA:18.55 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4p68 | DIHYDROFOLATEREDUCTASE (Escherichiacoli) |
PF00186(DHFR_1) | 5 | ALA A 7ASP A 27ILE A 50ILE A 94TYR A 100 | MTX A 201 ( 4.0A)MTX A 201 (-3.0A)MTX A 201 (-4.7A)MTX A 201 ( 4.3A)None | 0.41A | 3hbbA-4p68A:20.1 | 3hbbA-4p68A:17.62 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4rmb | SERINE RICH REPEATPROTEIN-1 (SRR-1) (Streptococcusagalactiae) |
PF10425(SdrG_C_C) | 5 | ASP A 574ILE A 599PRO A 600LEU A 606ILE A 522 | None | 0.98A | 3hbbA-4rmbA:undetectable | 3hbbA-4rmbA:15.53 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4xb1 | 319AA LONGHYPOTHETICALHOMOSERINEDEHYDROGENASE (Pyrococcushorikoshii) |
PF00742(Homoserine_dh)PF03447(NAD_binding_3) | 5 | ILE A 289ILE A 149PRO A 148LEU A 153ILE A 165 | None | 1.08A | 3hbbA-4xb1A:undetectable | 3hbbA-4xb1A:22.06 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4yg8 | CHITIN BIOSYNTHESISPROTEIN CHS6 (Saccharomycescerevisiae) |
PF09295(ChAPs) | 5 | ILE B 46ILE B 457LEU B 453ILE B 464TYR B 689 | None | 1.14A | 3hbbA-4yg8B:undetectable | 3hbbA-4yg8B:19.87 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4ysj | CALMODULIN-LIKEDOMAIN PROTEINKINASE (Eimeria tenella) |
PF00069(Pkinase)PF13499(EF-hand_7) | 5 | VAL A 135ALA A 276ILE A 274ILE A 262ILE A 132 | None | 1.02A | 3hbbA-4ysjA:undetectable | 3hbbA-4ysjA:21.97 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4z8g | TROPOMODULIN-1,LEIOMODIN-1 CHIMERA(TP1 ABS2) (Homo sapiens) |
no annotation | 5 | VAL A 375ALA A 215ILE A 389LEU A 392ILE A 379 | None | 1.14A | 3hbbA-4z8gA:undetectable | 3hbbA-4z8gA:17.43 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5a9g | MANGANESE SUPEROXIDEDISMUTASE (Sphingobacteriumspiritivorum) |
PF00081(Sod_Fe_N)PF02777(Sod_Fe_C) | 5 | VAL A 164ALA A 168ILE A 18ILE A 188LEU A 160 | None | 1.12A | 3hbbA-5a9gA:undetectable | 3hbbA-5a9gA:17.61 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5afe | ENDOGLUCANASE CEL5A ([Eubacterium]cellulosolvens) |
no annotation | 5 | ALA A 652ILE A 654ILE A 630LEU A 622ILE A 686 | None | 1.09A | 3hbbA-5afeA:undetectable | 3hbbA-5afeA:14.50 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5bnn | CAPSID PROTEIN VP2 (Enterovirus D) |
PF00073(Rhv) | 5 | VAL B 214ILE B 127PRO B 128LEU B 161ILE B 212 | None | 0.77A | 3hbbA-5bnnB:undetectable | 3hbbA-5bnnB:19.25 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5cyf | PUTATIVE URIDINEPHOSPHORYLASE (Schistosomamansoni) |
PF01048(PNP_UDP_1) | 5 | VAL A 252ILE A 51ILE A 86LEU A 287ILE A 120 | None | 0.98A | 3hbbA-5cyfA:undetectable | 3hbbA-5cyfA:20.57 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5d2e | MLNE (Bacillusvelezensis) |
PF08659(KR) | 5 | VAL A 330ALA A 332ILE A 357LEU A 354ILE A 302 | PG4 A 603 (-4.6A)PG4 A 603 (-3.9A)NoneNoneNone | 1.09A | 3hbbA-5d2eA:undetectable | 3hbbA-5d2eA:21.42 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5dxv | RETHREADED DHFR (syntheticconstruct) |
PF00186(DHFR_1) | 5 | ALA A 7ILE A 67LEU A 71ILE A 111TYR A 117 | NAP A 201 (-3.7A)PEG A 202 ( 4.9A)NoneNoneNone | 0.63A | 3hbbA-5dxvA:11.6 | 3hbbA-5dxvA:15.28 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5ffj | ENDONUCLEASE ANDMETHYLASE LLAGI (Lactococcuslactis) |
PF00271(Helicase_C)PF02384(N6_Mtase)PF04851(ResIII) | 5 | VAL A 320ALA A 324ILE A 335LEU A 233ILE A 318 | None | 1.06A | 3hbbA-5ffjA:3.0 | 3hbbA-5ffjA:17.97 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5gva | WD REPEAT ANDHMG-BOX DNA-BINDINGPROTEIN 1 (Homo sapiens) |
PF00400(WD40)PF12894(ANAPC4_WD40) | 5 | VAL A 139ALA A 97ILE A 76ILE A 120LEU A 151 | None | 1.13A | 3hbbA-5gvaA:undetectable | 3hbbA-5gvaA:20.82 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5jb3 | 30S RIBOSOMALPROTEIN S10 (Pyrococcusabyssi) |
PF00338(Ribosomal_S10) | 5 | ALA L 27ILE L 73MET L 82ILE L 96ILE L 88 | None | 1.08A | 3hbbA-5jb3L:undetectable | 3hbbA-5jb3L:11.24 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5jd3 | LAE5 (unculturedbacterium) |
PF13472(Lipase_GDSL_2) | 5 | ALA A 207ILE A 204ILE A 11LEU A 9ILE A 133 | None | 1.10A | 3hbbA-5jd3A:undetectable | 3hbbA-5jd3A:17.55 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5jfm | ALDEHYDEDEHYDROGENASE (Rhodopseudomonaspalustris) |
PF00171(Aldedh) | 5 | VAL A 303ILE A 342ILE A 347LEU A 406ILE A 336 | None | 1.11A | 3hbbA-5jfmA:2.3 | 3hbbA-5jfmA:22.66 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5jqn | ALIPHATIC AMIDASE (Nesterenkoniasp. AN1) |
PF00795(CN_hydrolase) | 5 | VAL A 56ALA A 58ILE A 94LEU A 42ILE A 52 | None | 1.04A | 3hbbA-5jqnA:undetectable | 3hbbA-5jqnA:21.44 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5kin | TRYPTOPHAN SYNTHASEALPHA CHAIN (Streptococcuspneumoniae) |
PF00290(Trp_syntA) | 5 | ALA A 70ASP A 28ILE A 51LEU A 43ILE A 236 | None | 1.02A | 3hbbA-5kinA:undetectable | 3hbbA-5kinA:19.73 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5mgx | PEPTIDYL-PROLYLCIS-TRANS ISOMERASEFKBP8 (Homo sapiens) |
PF00254(FKBP_C)PF07719(TPR_2) | 5 | VAL E 152ALA E 230PRO E 190LEU E 194ILE E 153 | None | 1.10A | 3hbbA-5mgxE:undetectable | 3hbbA-5mgxE:19.81 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 5t0l | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Toxoplasmagondii) |
PF00186(DHFR_1)PF00303(Thymidylat_synt) | 6 | VAL A 8ALA A 10ASP A 31PRO A 88LEU A 94TYR A 157 | 73X A 704 (-3.7A)73X A 704 (-4.0A)73X A 704 (-2.8A)73X A 704 (-4.0A)NoneNone | 0.65A | 3hbbA-5t0lA:18.5 | 3hbbA-5t0lA:44.80 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5u1c | HIV-1 INTEGRASE,SSO7D CHIMERA (Humanimmunodeficiencyvirus 1;Sulfolobussolfataricus) |
PF00552(IN_DBD_C)PF00665(rve)PF02022(Integrase_Zn) | 5 | VAL A 165ALA A 169ILE A 73LEU A 158ILE A 162 | None | 1.00A | 3hbbA-5u1cA:undetectable | 3hbbA-5u1cA:20.88 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5uf2 | RIBOSE-5-PHOSPHATEISOMERASE A (Neisseriagonorrhoeae) |
PF06026(Rib_5-P_isom_A) | 5 | ALA A 136ILE A 169PRO A 131LEU A 175ILE A 187 | NoneNoneNoneEDO A 309 (-4.4A)None | 1.08A | 3hbbA-5uf2A:undetectable | 3hbbA-5uf2A:20.35 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5uv4 | PUTATIVELEUCINE-RICH REPEATPROTEIN KINASEFAMILY PROTEIN (Zea mays) |
PF07714(Pkinase_Tyr) | 5 | VAL A 955ALA A1020ILE A 867LEU A 844ILE A 956 | None | 1.01A | 3hbbA-5uv4A:undetectable | 3hbbA-5uv4A:21.26 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5xfa | NAD-REDUCINGHYDROGENASE (Hydrogenophilusthermoluteolus) |
PF01058(Oxidored_q6) | 5 | VAL C 165ASP C 172ILE C 16LEU C 65ILE C 166 | None | 1.14A | 3hbbA-5xfaC:undetectable | 3hbbA-5xfaC:19.53 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 6cxm | DIHYDROFOLATEREDUCTASE (Mycolicibacteriumsmegmatis) |
no annotation | 7 | ALA A 8ILE A 21ASP A 28PRO A 52LEU A 58ILE A 92TYR A 98 | NAP A 201 (-3.9A)NAP A 201 (-3.8A)MMV A 202 (-2.9A)MMV A 202 ( 4.6A)MMV A 202 (-4.2A)MMV A 202 ( 4.2A)None | 0.71A | 3hbbA-6cxmA:19.5 | 3hbbA-6cxmA:8.64 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 6g6s | APOPTOTIC CHROMATINCONDENSATION INDUCERIN THE NUCLEUS (Homo sapiens) |
no annotation | 5 | ALA A1042ILE A1013ILE A1016LEU A1028ILE A1045 | None | 1.03A | 3hbbA-6g6sA:undetectable | 3hbbA-6g6sA:10.56 |