SIMILAR PATTERNS OF AMINO ACIDS FOR 3RUK_D_AERD601
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. | 1a4i | METHYLENETETRAHYDROFOLATE DEHYDROGENASE/METHENYLTETRAHYDROFOLATE CYCLOHYDROLASE (Homo sapiens) |
PF00763(THF_DHG_CYH)PF02882(THF_DHG_CYH_C) | 5 | ALA A 179ARG A 137ASP A 183GLY A 133ALA A 132 | None | 1.20A | 3rukD-1a4iA:undetectable | 3rukD-1a4iA:21.82 | ||
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. | 1amo | NADPH-CYTOCHROMEP450 REDUCTASE (Rattusnorvegicus) |
PF00175(NAD_binding_1)PF00258(Flavodoxin_1)PF00667(FAD_binding_1) | 5 | ALA A 112PHE A 83ASN A 79GLY A 109THR A 76 | None | 0.96A | 3rukD-1amoA:undetectable | 3rukD-1amoA:20.90 | ||
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. | 1avm | SUPEROXIDE DISMUTASE (Propionibacteriumfreudenreichii) |
PF00081(Sod_Fe_N)PF02777(Sod_Fe_C) | 5 | ILE A 100ASP A 108ALA A 112THR A 115VAL A 179 | None | 1.18A | 3rukD-1avmA:undetectable | 3rukD-1avmA:19.05 | ||
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. | 1b1c | PROTEIN(NADPH-CYTOCHROMEP450 REDUCTASE) (Homo sapiens) |
PF00258(Flavodoxin_1) | 5 | ALA A 52PHE A 23ASN A 19GLY A 49THR A 16 | None | 0.96A | 3rukD-1b1cA:undetectable | 3rukD-1b1cA:17.70 | ||
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. | 1ef9 | METHYLMALONYL COADECARBOXYLASE (Escherichiacoli) |
PF00378(ECH_1) | 5 | PHE A 32ILE A 88GLY A 110ALA A 111VAL A 103 | NoneNone2CP A 270 (-3.4A)NoneNone | 1.21A | 3rukD-1ef9A:undetectable | 3rukD-1ef9A:18.15 | ||
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. | 1fcu | HYALURONOGLUCOSAMINIDASE (Apis mellifera) |
PF01630(Glyco_hydro_56) | 5 | ALA A 248TYR A 14ILE A 299GLY A 297ALA A 295 | None | 1.20A | 3rukD-1fcuA:undetectable | 3rukD-1fcuA:22.38 | ||
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. | 1gz6 | ESTRADIOL 17BETA-DEHYDROGENASE 4 (Rattusnorvegicus) |
PF00106(adh_short) | 5 | TYR A 164ILE A 119GLY A 101ALA A 100VAL A 130 | NAI A1306 (-4.4A)NoneNAI A1306 (-3.6A)NAI A1306 (-3.4A)None | 1.10A | 3rukD-1gz6A:undetectable | 3rukD-1gz6A: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. | 1l5j | ACONITATE HYDRATASE2 (Escherichiacoli) |
PF00330(Aconitase)PF06434(Aconitase_2_N)PF11791(Aconitase_B_N) | 5 | TYR A 843ASN A 713ILE A 714ALA A 808THR A 788 | None | 1.12A | 3rukD-1l5jA:undetectable | 3rukD-1l5jA: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. | 1lns | X-PROLYL DIPEPTIDYLAMINOPEPTIDASE (Lactococcuslactis) |
PF02129(Peptidase_S15)PF08530(PepX_C)PF09168(PepX_N) | 5 | ALA A 283ASN A 318ILE A 314GLY A 340ALA A 338 | None | 1.08A | 3rukD-1lnsA:undetectable | 3rukD-1lnsA:20.32 | ||
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. | 1ne7 | GLUCOSAMINE-6-PHOSPHATE ISOMERASE (Homo sapiens) |
PF01182(Glucosamine_iso) | 5 | ALA A 12ILE A 201ALA A 243THR A 244VAL A 252 | None | 1.21A | 3rukD-1ne7A:undetectable | 3rukD-1ne7A:19.01 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 1nr6 | CYTOCHROME P450 2C5 (Oryctolaguscuniculus) |
PF00067(p450) | 7 | ALA A 113PHE A 114ASP A 290GLY A 293ALA A 294THR A 298VAL A 474 | DIF A 501 (-3.6A)DIF A 501 (-4.5A)NoneDIF A 501 (-3.8A)DIF A 501 ( 3.3A)HEM A 500 ( 3.6A)None | 1.38A | 3rukD-1nr6A:43.4 | 3rukD-1nr6A:32.81 | ||
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. | 1o9j | ALDEHYDEDEHYDROGENASE,CYTOSOLIC 1 (Elephantulusedwardii) |
PF00171(Aldedh) | 5 | ALA A 117ASN A 41GLY A 111ALA A 110THR A 197 | None | 1.14A | 3rukD-1o9jA:undetectable | 3rukD-1o9jA:21.48 | ||
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. | 1sb3 | 4-HYDROXYBENZOYL-COAREDUCTASE ALPHASUBUNIT (Thaueraaromatica) |
PF01315(Ald_Xan_dh_C)PF02738(Ald_Xan_dh_C2) | 5 | ALA A 356TYR A 217ASN A 518THR A 448VAL A 445 | PCD A1920 ( 4.2A)NoneNoneNoneNone | 1.04A | 3rukD-1sb3A:undetectable | 3rukD-1sb3A: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. | 1sqj | OLIGOXYLOGLUCANREDUCING-END-SPECIFIC CELLOBIOHYDROLASE (Geotrichum sp.M128) |
PF15899(BNR_6) | 5 | ALA A 294ASN A 216GLY A 220ALA A 221VAL A 279 | None | 0.93A | 3rukD-1sqjA:undetectable | 3rukD-1sqjA:19.88 | ||
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. | 1tuu | ACETATE KINASE (Methanosarcinathermophila) |
PF00871(Acetate_kinase) | 5 | ASN A 335GLY A 331ALA A 330THR A 382VAL A 187 | ADP A 401 (-3.7A)ADP A 401 (-3.2A)ADP A 401 ( 3.9A)NoneNone | 1.17A | 3rukD-1tuuA:undetectable | 3rukD-1tuuA:23.22 | ||
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. | 1tuu | ACETATE KINASE (Methanosarcinathermophila) |
PF00871(Acetate_kinase) | 6 | PHE A 305ASN A 335GLY A 331ALA A 330THR A 329VAL A 327 | NoneADP A 401 (-3.7A)ADP A 401 (-3.2A)ADP A 401 ( 3.9A)NoneNone | 1.22A | 3rukD-1tuuA:undetectable | 3rukD-1tuuA:23.22 | ||
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. | 1wa4 | PCZA361.16 (Amycolatopsisorientalis) |
PF00908(dTDP_sugar_isom) | 5 | ALA A 153TYR A 64ILE A 89ASP A 151ALA A 177 | None | 1.20A | 3rukD-1wa4A:undetectable | 3rukD-1wa4A:17.75 | ||
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. | 1xf1 | C5A PEPTIDASE (Streptococcuspyogenes) |
PF00082(Peptidase_S8)PF02225(PA)PF06280(fn3_5)PF13585(CHU_C) | 5 | ALA A 760PHE A 758ARG A 811GLY A 796ALA A 795 | None | 1.05A | 3rukD-1xf1A:undetectable | 3rukD-1xf1A:18.66 | ||
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. | 1yqe | HYPOTHETICAL UPF0204PROTEIN AF0625 (Archaeoglobusfulgidus) |
PF04414(tRNA_deacylase) | 5 | ALA A 236ILE A 202GLY A 189THR A 137VAL A 89 | None | 1.21A | 3rukD-1yqeA:undetectable | 3rukD-1yqeA:23.82 | ||
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. | 1ytm | PHOSPHOENOLPYRUVATECARBOXYKINASE [ATP] (Anaerobiospirillumsucciniciproducens) |
PF01293(PEPCK_ATP) | 5 | ALA A 425ILE A 221GLY A 271ALA A 347VAL A 351 | None | 1.08A | 3rukD-1ytmA:undetectable | 3rukD-1ytmA:21.45 | ||
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. | 1zwt | MAJOR STRUCTURALSUBUNIT OFBUNDLE-FORMING PILUS (Escherichiacoli) |
PF05307(Bundlin) | 5 | ALA A 130PHE A 122ASN A 117GLY A 115THR A 62 | None | 1.19A | 3rukD-1zwtA:undetectable | 3rukD-1zwtA:14.31 | ||
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. | 2ay9 | AROMATIC AMINO ACIDAMINOTRANSFERASE (Paracoccusdenitrificans) |
PF00155(Aminotran_1_2) | 5 | ASN A 393ILE A 397GLY A 391ALA A 390VAL A 326 | None | 1.16A | 3rukD-2ay9A:undetectable | 3rukD-2ay9A:22.42 | ||
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. | 2bxy | MALTOOLIGOSYLTREHALOSE TREHALOHYDROLASE (Deinococcusradiodurans) |
PF00128(Alpha-amylase)PF02922(CBM_48)PF11941(DUF3459) | 5 | ALA A 104GLY A 26ALA A 27THR A 36VAL A 73 | None | 1.13A | 3rukD-2bxyA:undetectable | 3rukD-2bxyA:20.23 | ||
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. | 2c7z | 3-KETOACYL-COATHIOLASE 2 (Arabidopsisthaliana) |
PF00108(Thiolase_N)PF02803(Thiolase_C) | 5 | ALA A 119GLY A 299ALA A 298THR A 60VAL A 241 | None | 0.99A | 3rukD-2c7zA:undetectable | 3rukD-2c7zA:22.09 | ||
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. | 2cwl | MANGANESE-FREEPSEUDOCATALASE (Thermusthermophilus) |
PF05067(Mn_catalase) | 5 | ALA A 121TYR A 291ASP A 277GLY A 275ALA A 274 | None | 1.17A | 3rukD-2cwlA:undetectable | 3rukD-2cwlA:19.88 | ||
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. | 2f6b | FAMILY 11 XYLANASE (Bacillus) |
PF00457(Glyco_hydro_11) | 5 | ALA A 192ASN A 45GLY A 185ALA A 80VAL A 98 | None | 1.18A | 3rukD-2f6bA:undetectable | 3rukD-2f6bA:17.34 | ||
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. | 2fav | REPLICASEPOLYPROTEIN 1AB(PP1AB) (ORF1AB) (Severe acuterespiratorysyndrome-relatedcoronavirus) |
PF01661(Macro) | 5 | PHE A 133ILE A 42GLY A 79ALA A 113VAL A 37 | None | 0.84A | 3rukD-2favA:undetectable | 3rukD-2favA:17.77 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2hi4 | CYTOCHROME P450 1A2 (Homo sapiens) |
PF00067(p450) | 5 | PHE A 125ASP A 313GLY A 316ALA A 317THR A 321 | NoneBHF A 800 (-3.9A)BHF A 800 (-3.8A)HEM A 900 ( 3.5A)HEM A 900 ( 3.1A) | 0.72A | 3rukD-2hi4A:40.9 | 3rukD-2hi4A:32.31 | ||
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. | 2iir | ACETATE KINASE (Thermotogamaritima) |
PF00871(Acetate_kinase) | 6 | ALA A 212ASN A 335GLY A 331ALA A 330THR A 384VAL A 186 | None | 1.27A | 3rukD-2iirA:undetectable | 3rukD-2iirA: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. | 2iir | ACETATE KINASE (Thermotogamaritima) |
PF00871(Acetate_kinase) | 5 | ALA A 212ASN A 335GLY A 331ALA A 330VAL A 327 | None | 1.02A | 3rukD-2iirA:undetectable | 3rukD-2iirA: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. | 2iir | ACETATE KINASE (Thermotogamaritima) |
PF00871(Acetate_kinase) | 5 | ASN A 335GLY A 331ALA A 330THR A 329VAL A 327 | None | 1.21A | 3rukD-2iirA:undetectable | 3rukD-2iirA: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. | 2ldx | APO-LACTATEDEHYDROGENASE (Mus musculus) |
PF00056(Ldh_1_N)PF02866(Ldh_1_C) | 5 | ALA A 52ASN A 112GLY A 96ALA A 95VAL A 123 | None | 1.21A | 3rukD-2ldxA:undetectable | 3rukD-2ldxA:23.28 | ||
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. | 2n4x | CYTOCHROME C-TYPEBIOGENESIS PROTEIN(CCDA) (Archaeoglobusfulgidus) |
no annotation | 5 | ALA A 118GLY A 173ALA A 174THR A 149VAL A 153 | None | 1.15A | 3rukD-2n4xA:undetectable | 3rukD-2n4xA:20.65 | ||
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. | 2p4o | HYPOTHETICAL PROTEIN (Nostocpunctiforme) |
no annotation | 5 | ALA A 115ARG A 160ASP A 133GLY A 137ALA A 138 | None | 1.18A | 3rukD-2p4oA:undetectable | 3rukD-2p4oA:21.13 | ||
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. | 2qjj | MANDELATERACEMASE/MUCONATELACTONIZING ENZYME (Novosphingobiumaromaticivorans) |
PF02746(MR_MLE_N)PF13378(MR_MLE_C) | 5 | ILE A 9ASP A 33GLY A 32ALA A 88VAL A 51 | None | 1.18A | 3rukD-2qjjA:undetectable | 3rukD-2qjjA:21.36 | ||
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. | 2r3b | YJEF-RELATED PROTEIN (Enterococcusfaecalis) |
PF01256(Carb_kinase) | 5 | ILE A 262ASP A 216GLY A 220ALA A 219VAL A 185 | NoneEDO A 294 (-3.4A)NoneNoneNone | 1.19A | 3rukD-2r3bA:undetectable | 3rukD-2r3bA: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. | 2rgh | ALPHA-GLYCEROPHOSPHATE OXIDASE (Streptococcussp.) |
PF01266(DAO)PF16901(DAO_C) | 5 | ALA A 131TYR A 274GLY A 66THR A 431VAL A 89 | NoneNoneNoneFAD A 609 (-4.3A)None | 1.11A | 3rukD-2rghA:undetectable | 3rukD-2rghA:21.48 | ||
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. | 2ri8 | MANNOSYL-OLIGOSACCHARIDEALPHA-1,2-MANNOSIDASE (Penicilliumcitrinum) |
PF01532(Glyco_hydro_47) | 5 | ASN A1194ILE A1248ASP A1266ALA A1197THR A1201 | NoneNoneNoneGOL A1900 (-3.3A)None | 1.20A | 3rukD-2ri8A:undetectable | 3rukD-2ri8A:22.53 | ||
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. | 2rld | UNCHARACTERIZEDPROTEIN (Bacteroidesthetaiotaomicron) |
PF05635(23S_rRNA_IVP) | 5 | TYR A 96ASN A 100ILE A 99ALA A 75VAL A 10 | None | 1.10A | 3rukD-2rldA:undetectable | 3rukD-2rldA:12.65 | ||
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. | 2y9e | MYOSIN-2 (Dictyosteliumdiscoideum) |
PF00063(Myosin_head)PF02736(Myosin_N) | 5 | ALA X 183ASN X 475ILE X 455GLY X 457VAL X 681 | None | 1.21A | 3rukD-2y9eX:undetectable | 3rukD-2y9eX:21.94 | ||
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. | 2ztu | D(-)-3-HYDROXYBUTYRATE DEHYDROGENASE (Pseudomonasfragi) |
PF13561(adh_short_C2) | 5 | TYR A 155ILE A 110GLY A 92ALA A 91VAL A 70 | NAD A 300 (-4.3A)NoneNAD A 300 (-3.6A)NAD A 300 ( 4.0A)None | 1.18A | 3rukD-2ztuA:undetectable | 3rukD-2ztuA:19.84 | ||
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. | 3ajx | 3-HEXULOSE-6-PHOSPHATE SYNTHASE (Mycobacteriumgastri) |
PF00215(OMPdecase) | 5 | ALA A1199ILE A1007GLY A1186ALA A1185VAL A1182 | NoneNoneSO4 A6001 (-3.2A)NoneNone | 1.17A | 3rukD-3ajxA:undetectable | 3rukD-3ajxA:18.80 | ||
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. | 3b9y | AMMONIUM TRANSPORTERFAMILY RH-LIKEPROTEIN (Nitrosomonaseuropaea) |
PF00909(Ammonium_transp) | 5 | ALA A 273GLY A 241ALA A 242THR A 246VAL A 298 | None | 0.71A | 3rukD-3b9yA:undetectable | 3rukD-3b9yA: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. | 3be7 | ZN-DEPENDENTARGININECARBOXYPEPTIDASE (unidentified) |
PF01979(Amidohydro_1) | 5 | ALA A 325PHE A 328ILE A 55ALA A 97VAL A 102 | None | 1.15A | 3rukD-3be7A:undetectable | 3rukD-3be7A:23.55 | ||
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. | 3c5c | RAS-LIKE PROTEIN 12 (Homo sapiens) |
PF00071(Ras) | 5 | ALA A 76ASN A 134GLY A 32THR A 37VAL A 72 | NoneGDP A 201 (-3.3A)GDP A 201 (-3.2A)NoneNone | 1.21A | 3rukD-3c5cA:undetectable | 3rukD-3c5cA:17.21 | ||
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. | 3frk | QDTB (Thermoanaerobacteriumthermosaccharolyticum) |
PF01041(DegT_DnrJ_EryC1) | 5 | PHE A 285ASN A 362ILE A 361GLY A 263ALA A 262 | None | 1.19A | 3rukD-3frkA:undetectable | 3rukD-3frkA:25.88 | ||
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. | 3h5o | TRANSCRIPTIONALREGULATOR GNTR (Chromobacteriumviolaceum) |
PF13377(Peripla_BP_3) | 5 | ALA A 288ILE A 177ASP A 256ALA A 259VAL A 273 | None | 1.12A | 3rukD-3h5oA:undetectable | 3rukD-3h5oA:21.93 | ||
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. | 3l2n | PEPTIDASE M14,CARBOXYPEPTIDASE A (Shewanelladenitrificans) |
PF00246(Peptidase_M14) | 5 | ALA A 366PHE A 289ILE A 161GLY A 360VAL A 267 | None | 1.19A | 3rukD-3l2nA:undetectable | 3rukD-3l2nA:21.78 | ||
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. | 3mmt | FRUCTOSE-BISPHOSPHATE ALDOLASE (Bartonellahenselae) |
PF00274(Glycolytic) | 5 | ILE A 8ARG A 4GLY A 172ALA A 171VAL A 98 | None | 1.14A | 3rukD-3mmtA:undetectable | 3rukD-3mmtA:20.84 | ||
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. | 3nzm | DNA POLYMERASE IIISUBUNIT ALPHA (Synechocystissp. PCC 6803) |
no annotation | 5 | ALA A 119ASN A 148ILE A 156THR A 41VAL A 11 | None | 1.13A | 3rukD-3nzmA:undetectable | 3rukD-3nzmA:16.53 | ||
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. | 3oss | TYPE 2 SECRETIONSYSTEM, GSPCTYPE 2 SECRETIONSYSTEM, SECRETINGSPD (Escherichiacoli) |
PF03958(Secretin_N)PF11356(T2SSC) | 5 | ALA C 133PHE D 9ILE D 18GLY D 22ALA D 23 | None | 1.20A | 3rukD-3ossC:undetectable | 3rukD-3ossC:10.35 | ||
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. | 3pm0 | CYTOCHROME P450 1B1 (Homo sapiens) |
PF00067(p450) | 6 | ALA A 133ASP A 326GLY A 329ALA A 330THR A 334VAL A 395 | HEM A 900 (-3.3A)BHF A 800 (-3.4A)BHF A 800 ( 4.0A)HEM A 900 ( 3.4A)HEM A 900 ( 3.2A)HEM A 900 (-4.6A) | 0.69A | 3rukD-3pm0A:41.1 | 3rukD-3pm0A:29.69 | ||
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. | 3pm0 | CYTOCHROME P450 1B1 (Homo sapiens) |
PF00067(p450) | 6 | ALA A 133PHE A 134ASP A 326GLY A 329ALA A 330THR A 334 | HEM A 900 (-3.3A)BHF A 800 (-4.8A)BHF A 800 (-3.4A)BHF A 800 ( 4.0A)HEM A 900 ( 3.4A)HEM A 900 ( 3.2A) | 0.56A | 3rukD-3pm0A:41.1 | 3rukD-3pm0A:29.69 | ||
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. | 3r9p | ACKA (Mycobacteriumavium) |
PF00871(Acetate_kinase) | 5 | ASN A 323GLY A 319ALA A 318THR A 371VAL A 176 | None | 1.21A | 3rukD-3r9pA:undetectable | 3rukD-3r9pA:22.43 | ||
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. | 3ruy | ORNITHINEAMINOTRANSFERASE (Bacillusanthracis) |
PF00202(Aminotran_3) | 5 | ALA A 374ASN A 202ILE A 203GLY A 197THR A 366 | None | 1.19A | 3rukD-3ruyA:undetectable | 3rukD-3ruyA:21.76 | ||
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. | 3tbk | RIG-I HELICASEDOMAIN (Mus musculus) |
PF00271(Helicase_C)PF04851(ResIII) | 5 | ALA A 265ILE A 428ALA A 441THR A 261VAL A 407 | None | 1.07A | 3rukD-3tbkA:undetectable | 3rukD-3tbkA:24.79 | ||
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. | 3thu | MANDELATE RACEMASE /MUCONATE LACTONIZINGENZYME FAMILYPROTEIN (Sphingomonassp. SKA58) |
PF02746(MR_MLE_N)PF13378(MR_MLE_C) | 5 | ILE A 10ASP A 34GLY A 33ALA A 89VAL A 52 | None | 1.18A | 3rukD-3thuA:undetectable | 3rukD-3thuA:20.53 | ||
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. | 3tpf | ORNITHINECARBAMOYLTRANSFERASE (Campylobacterjejuni) |
PF00185(OTCace)PF02729(OTCace_N) | 5 | ALA A 190PHE A 189GLY A 169ALA A 165VAL A 128 | None | 1.19A | 3rukD-3tpfA:undetectable | 3rukD-3tpfA:22.18 | ||
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. | 3u4g | NAMN:DMBPHOSPHORIBOSYLTRANSFERASE (Pyrococcushorikoshii) |
no annotation | 5 | ILE A 80GLY A 302ALA A 303THR A 307VAL A 320 | None | 1.08A | 3rukD-3u4gA:undetectable | 3rukD-3u4gA:21.83 | ||
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. | 3umm | PHOSPHORIBOSYLFORMYLGLYCINAMIDINESYNTHASE (Salmonellaenterica) |
PF02769(AIRS_C)PF13507(GATase_5) | 5 | ASN A 722ILE A 723GLY A 698ALA A 715VAL A 857 | ADP A2005 ( 2.7A)NoneNoneNoneNone | 1.10A | 3rukD-3ummA:undetectable | 3rukD-3ummA:16.65 | ||
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. | 4c1t | SUGAR TRANSPORTERSOLUTE-BINDINGPROTEIN (Bifidobacteriumanimalis) |
PF01547(SBP_bac_1) | 5 | ASN A 245ILE A 187GLY A 190ALA A 253VAL A 281 | None | 1.16A | 3rukD-4c1tA:undetectable | 3rukD-4c1tA:21.13 | ||
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. | 4c5n | PHOSPHOMETHYLPYRIMIDINE KINASE (Staphylococcusaureus) |
PF08543(Phos_pyr_kin) | 5 | ALA A 40ILE A 87GLY A 79ALA A 10THR A 8 | None | 1.19A | 3rukD-4c5nA:undetectable | 3rukD-4c5nA:22.61 | ||
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. | 4dq8 | ACETATE KINASE (Mycobacteriummarinum) |
PF00871(Acetate_kinase) | 5 | ALA A 202GLY A 319ALA A 318THR A 371VAL A 176 | None | 1.21A | 3rukD-4dq8A:undetectable | 3rukD-4dq8A:22.82 | ||
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. | 4fdg | MINICHROMOSOMEMAINTENANCE PROTEINMCM (Sulfolobussolfataricus) |
no annotation | 5 | ALA B 401ILE B 126GLY B 391ALA B 392VAL B 426 | None | 1.09A | 3rukD-4fdgB:undetectable | 3rukD-4fdgB: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. | 4i1i | MALATE DEHYDROGENASE (Leishmaniamajor) |
PF00056(Ldh_1_N)PF02866(Ldh_1_C) | 5 | PHE A 218TYR A 261ASN A 180ALA A 205VAL A 173 | EDO A 405 ( 4.4A)NoneNoneNoneNone | 1.20A | 3rukD-4i1iA:undetectable | 3rukD-4i1iA:18.97 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4i8v | CYTOCHROME P450 1A1 (Homo sapiens) |
PF00067(p450) | 5 | ASP A 313GLY A 316ALA A 317THR A 321VAL A 382 | BHF A 602 (-3.7A)BHF A 602 (-3.5A)BHF A 602 ( 3.4A)HEM A 601 (-3.4A)HEM A 601 (-4.9A) | 0.73A | 3rukD-4i8vA:42.1 | 3rukD-4i8vA:33.85 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4i8v | CYTOCHROME P450 1A1 (Homo sapiens) |
PF00067(p450) | 5 | PHE A 123ASP A 313GLY A 316ALA A 317THR A 321 | NoneBHF A 602 (-3.7A)BHF A 602 (-3.5A)BHF A 602 ( 3.4A)HEM A 601 (-3.4A) | 0.66A | 3rukD-4i8vA:42.1 | 3rukD-4i8vA:33.85 | ||
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. | 4ip4 | MANDELATERACEMASE/MUCONATELACTONIZINGENZYME-LIKE PROTEIN (Ruegeria sp.TM1040) |
PF02746(MR_MLE_N)PF13378(MR_MLE_C) | 5 | ALA A 64ASN A 116GLY A 112ALA A 111VAL A 72 | None | 1.19A | 3rukD-4ip4A:undetectable | 3rukD-4ip4A:22.74 | ||
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. | 4kcd | GLUTAMATE RECEPTORIONOTROPIC, NMDA 3A (Rattusnorvegicus) |
PF10613(Lig_chan-Glu_bd) | 5 | ILE A 266GLY A 255ALA A 120THR A 122VAL A 18 | None | 1.21A | 3rukD-4kcdA:undetectable | 3rukD-4kcdA:19.84 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4nky | STEROID17-ALPHA-HYDROXYLASE/17,20 LYASE (Homo sapiens) |
PF00067(p450) | 11 | ALA A 113PHE A 114TYR A 201ASN A 202ILE A 205ARG A 239ASP A 298GLY A 301ALA A 302THR A 306VAL A 366 | HEM A 600 ( 2.9A)3QZ A 601 ( 4.1A)None3QZ A 601 (-3.5A)3QZ A 601 ( 3.4A)3QZ A 601 ( 4.4A)3QZ A 601 (-3.5A)3QZ A 601 ( 3.0A)3QZ A 601 (-2.9A)HEM A 600 ( 3.2A)HEM A 600 ( 3.4A) | 0.37A | 3rukD-4nkyA:59.3 | 3rukD-4nkyA:99.80 | ||
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. | 4qan | HYPOTHETICAL PROTEIN ([Ruminococcus]gnavus) |
no annotation | 5 | ILE A 341GLY A 369ALA A 386THR A 371VAL A 352 | None | 1.17A | 3rukD-4qanA:undetectable | 3rukD-4qanA:21.57 | ||
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. | 4qi4 | CELLOBIOSEDEHYDROGENASE (Crassicarponhotsonii) |
PF00732(GMC_oxred_N)PF00734(CBM_1)PF05199(GMC_oxred_C) | 5 | ALA A 738ASP A 737GLY A 238ALA A 239THR A 318 | FAD A 901 (-3.4A)FAD A 901 (-4.3A)FAD A 901 (-3.3A)FAD A 901 (-3.1A)None | 1.18A | 3rukD-4qi4A:undetectable | 3rukD-4qi4A:22.59 | ||
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. | 4qni | UNCHARACTERIZEDPROTEIN (Bacteroidesthetaiotaomicron) |
PF14274(DUF4361)PF16343(DUF4973) | 5 | PHE A 257ASN A 202ILE A 200GLY A 241ALA A 240 | EDO A 403 (-4.9A)EDO A 403 ( 4.9A)EDO A 403 ( 4.1A)EDO A 403 (-3.6A)None | 1.12A | 3rukD-4qniA:undetectable | 3rukD-4qniA:20.83 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4r1z | CYP17A1 PROTEIN (Danio rerio) |
PF00067(p450) | 6 | ALA A 126PHE A 127ASP A 309ALA A 313THR A 317VAL A 494 | HEM A 600 (-3.6A)NoneAER A 601 ( 4.1A)HEM A 600 (-3.5A)HEM A 600 ( 3.3A)None | 1.43A | 3rukD-4r1zA:51.0 | 3rukD-4r1zA:46.17 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4r1z | CYP17A1 PROTEIN (Danio rerio) |
PF00067(p450) | 10 | ALA A 126PHE A 127TYR A 214ILE A 218ARG A 252ASP A 309GLY A 312ALA A 313THR A 317VAL A 377 | HEM A 600 (-3.6A)NoneAER A 601 (-4.7A)AER A 601 ( 4.3A)NoneAER A 601 ( 4.1A)AER A 601 ( 3.7A)HEM A 600 (-3.5A)HEM A 600 ( 3.3A)HEM A 600 (-4.6A) | 0.57A | 3rukD-4r1zA:51.0 | 3rukD-4r1zA:46.17 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4r20 | CYTOCHROME P450FAMILY 17POLYPEPTIDE 2 (Danio rerio) |
PF00067(p450) | 5 | ALA A 120PHE A 121ILE A 216THR A 306VAL A 366 | AER A 602 (-3.7A)NoneNoneHEM A 601 ( 3.3A)AER A 602 ( 4.9A) | 1.21A | 3rukD-4r20A:49.4 | 3rukD-4r20A:43.90 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4r20 | CYTOCHROME P450FAMILY 17POLYPEPTIDE 2 (Danio rerio) |
PF00067(p450) | 10 | ALA A 120PHE A 121TYR A 208ASN A 209ILE A 212ARG A 246GLY A 301ALA A 302THR A 306VAL A 366 | AER A 602 (-3.7A)NoneNoneAER A 602 (-4.5A)AER A 602 (-3.2A)NoneAER A 602 ( 3.8A)HEM A 601 (-3.4A)HEM A 601 ( 3.3A)AER A 602 ( 4.9A) | 0.80A | 3rukD-4r20A:49.4 | 3rukD-4r20A:43.90 | ||
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. | 4wlh | KYNURENINE--OXOGLUTARATE TRANSAMINASE 1 (Homo sapiens) |
PF00155(Aminotran_1_2) | 5 | ALA A 287PHE A 50GLY A 246ALA A 245VAL A 96 | NoneNoneLLP A 247 ( 2.4A)NoneNone | 1.20A | 3rukD-4wlhA:undetectable | 3rukD-4wlhA:24.72 | ||
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. | 4wv4 | TRANSCRIPTIONINITIATION FACTORTFIID SUBUNIT 10TRANSCRIPTIONINITIATION FACTORTFIID SUBUNIT 8 (Homo sapiens) |
PF03540(TFIID_30kDa)PF07524(Bromo_TP) | 5 | ALA A 146ILE B 69GLY B 73ALA B 76THR B 96 | None | 1.00A | 3rukD-4wv4A:undetectable | 3rukD-4wv4A:12.15 | ||
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. | 4wzz | PUTATIVE SUGAR ABCTRANSPORTER,SUBSTRATE-BINDINGPROTEIN (Lachnoclostridiumphytofermentans) |
PF13407(Peripla_BP_4) | 5 | ALA A 251ILE A 170GLY A 268ALA A 242VAL A 213 | None | 1.03A | 3rukD-4wzzA:undetectable | 3rukD-4wzzA:20.92 | ||
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. | 5dgk | ACTIVE HELICASE (Staphylococcusaureus) |
PF06048(DUF927) | 5 | ILE A 127GLY A 257ALA A 187THR A 190VAL A 402 | None | 1.08A | 3rukD-5dgkA:undetectable | 3rukD-5dgkA:22.52 | ||
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. | 5dgq | PUTATIVEENDOGLUCANASE-RELATED PROTEIN (Photobacteriumprofundum) |
PF00759(Glyco_hydro_9) | 5 | ALA A 318ASN A 158ILE A 310GLY A 249ALA A 250 | None | 1.19A | 3rukD-5dgqA:undetectable | 3rukD-5dgqA:21.91 | ||
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. | 5gqf | LACTO-N-BIOSIDASE (Bifidobacteriumlongum) |
no annotation | 5 | TYR A 431ASN A 457GLY A 558ALA A 557VAL A 532 | None | 1.15A | 3rukD-5gqfA:undetectable | 3rukD-5gqfA:23.04 | ||
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. | 5gxd | AMP-DEPENDENTSYNTHETASE ANDLIGASE (Dinoroseobactershibae) |
PF00501(AMP-binding)PF13193(AMP-binding_C)PF16177(ACAS_N) | 5 | ALA A 524PHE A 540ASN A 596ILE A 597GLY A 592 | None | 1.03A | 3rukD-5gxdA:undetectable | 3rukD-5gxdA:19.84 | ||
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. | 5jjc | CYSTEINE SYNTHASE (Brucellaabortus) |
PF00291(PALP) | 5 | ALA A 109TYR A 309ARG A 308GLY A 71VAL A 114 | None | 1.11A | 3rukD-5jjcA:undetectable | 3rukD-5jjcA:21.29 | ||
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. | 5nx4 | PENTALENENE SYNTHASE (Streptomycesclavuligerus) |
no annotation | 5 | PHE A 82ILE A 116ALA A 97THR A 100VAL A 144 | None | 1.18A | 3rukD-5nx4A:undetectable | 3rukD-5nx4A:20.08 | ||
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. | 5ojy | TETR FAMILYTRANSCRIPTIONREGULATOR (Streptomycesalboniger) |
no annotation | 5 | TYR A 164ILE A 163ASP A 103GLY A 107ALA A 106 | None | 1.07A | 3rukD-5ojyA:undetectable | 3rukD-5ojyA:9.92 | ||
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. | 5t95 | PREPHENATEDEHYDROGENASE 1 (Glycine max) |
PF02153(PDH) | 5 | ALA A 37PHE A 54GLY A 18THR A 73VAL A 81 | NoneNoneNAP A 301 (-3.4A)NAP A 301 (-4.1A)NAP A 301 (-4.7A) | 1.07A | 3rukD-5t95A:undetectable | 3rukD-5t95A:21.49 | ||
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. | 5tz8 | GLYCOSYL TRANSFERASE (Staphylococcusaureus) |
PF00535(Glycos_transf_2) | 5 | ASN A 335ILE A 329ASP A 349GLY A 347VAL A 315 | None | 1.09A | 3rukD-5tz8A:undetectable | 3rukD-5tz8A:22.11 | ||
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. | 5tzk | GLYCOSYL TRANSFERASE (Staphylococcusaureus) |
PF00535(Glycos_transf_2) | 5 | ASN C 335ILE C 329ASP C 349GLY C 347VAL C 315 | None | 1.08A | 3rukD-5tzkC:undetectable | 3rukD-5tzkC:22.31 | ||
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. | 5urb | METHIONINE--TRNALIGASE (Acinetobacterbaumannii) |
PF08264(Anticodon_1)PF09334(tRNA-synt_1g) | 5 | ALA A 164TYR A 235ARG A 231ASP A 135THR A 173 | NoneNoneNO3 A 608 (-3.8A)NO3 A 608 (-4.8A)NO3 A 609 ( 4.4A) | 1.07A | 3rukD-5urbA:undetectable | 3rukD-5urbA:21.48 | ||
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. | 5v8l | PGT145 ANTIBODY,LIGHT CHAIN (Homo sapiens) |
PF07686(V-set) | 5 | PHE N 62ARG N 39ASP N 82GLY N 84THR N 102 | None | 1.12A | 3rukD-5v8lN:undetectable | 3rukD-5v8lN:19.11 | ||
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. | 5vj1 | MDCA (Pseudomonasaeruginosa) |
PF16957(Mal_decarbox_Al) | 5 | ASN A 148ILE A 146ARG A 14GLY A 184VAL A 152 | None | 1.20A | 3rukD-5vj1A:undetectable | 3rukD-5vj1A:23.32 | ||
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. | 5xbl | CRISPR-ASSOCIATEDENDONUCLEASECAS9/CSN1 (Streptococcuspyogenes) |
PF13395(HNH_4)PF16592(Cas9_REC)PF16593(Cas9-BH)PF16595(Cas9_PI) | 5 | ILE A 492ARG A 635GLY A 485ALA A 486THR A 466 | None | 1.10A | 3rukD-5xblA:undetectable | 3rukD-5xblA:17.06 | ||
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. | 5y1i | CYTOCHROME P450 (Streptomycesgraminofaciens) |
PF00067(p450) | 5 | PHE A 89ASN A 181GLY A 247ALA A 248THR A 252 | NoneNoneNoneHEM A 501 (-3.4A)HEM A 501 (-3.9A) | 1.13A | 3rukD-5y1iA:30.7 | 3rukD-5y1iA:24.55 | ||
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. | 6b82 | CYTOCHROME P450,FAMILY 17, SUBFAMILYA, POLYPEPTIDE 1 (Danio rerio) |
no annotation | 8 | ALA A 126PHE A 127TYR A 214ILE A 218GLY A 312ALA A 313THR A 317VAL A 377 | HEM A 601 (-3.8A)NoneNoneAER A 602 (-3.9A)AER A 602 ( 3.7A)HEM A 601 (-3.6A)HEM A 601 ( 3.7A)HEM A 601 ( 4.4A) | 0.52A | 3rukD-6b82A:48.7 | 3rukD-6b82A:9.72 | ||
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. | 6b82 | CYTOCHROME P450,FAMILY 17, SUBFAMILYA, POLYPEPTIDE 1 (Danio rerio) |
no annotation | 8 | ALA A 126TYR A 214ILE A 218ARG A 252GLY A 312ALA A 313THR A 317VAL A 377 | HEM A 601 (-3.8A)NoneAER A 602 (-3.9A)NoneAER A 602 ( 3.7A)HEM A 601 (-3.6A)HEM A 601 ( 3.7A)HEM A 601 ( 4.4A) | 0.64A | 3rukD-6b82A:48.7 | 3rukD-6b82A:9.72 | ||
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. | 6f0k | POLYSULPHIDEREDUCTASE NRFD (Rhodothermusmarinus) |
no annotation | 5 | TYR C 340ASN C 344ILE C 343GLY C 348ALA C 351 | None | 1.05A | 3rukD-6f0kC:undetectable | 3rukD-6f0kC:10.99 | ||
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. | 6f42 | DNA-DIRECTED RNAPOLYMERASE IIISUBUNIT RPC1 (Saccharomycescerevisiae) |
no annotation | 5 | ASN A 625ILE A 624ARG A 937ALA A 942THR A 946 | None | 1.13A | 3rukD-6f42A:undetectable | 3rukD-6f42A:9.72 | ||
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. | 6g72 | NADH DEHYDROGENASE[UBIQUINONE]IRON-SULFUR PROTEIN7, MITOCHONDRIALNADH DEHYDROGENASE[UBIQUINONE]IRON-SULFUR PROTEIN8, MITOCHONDRIAL (Mus musculus) |
no annotation | 5 | ALA B 63TYR I 120ILE I 119GLY B 127VAL B 143 | SF4 B 201 (-3.3A)NoneSF4 I 201 (-4.6A)SF4 B 201 ( 4.2A)None | 1.09A | 3rukD-6g72B:undetectable | 3rukD-6g72B:12.15 |