SIMILAR PATTERNS OF AMINO ACIDS FOR 3EKQ_A_ROCA100_2
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. | 1ddg | SULFITE REDUCTASE(NADPH) FLAVOPROTEINALPHA-COMPONENT (Escherichiacoli) |
PF00175(NAD_binding_1)PF00667(FAD_binding_1) | 5 | LEU A 241VAL A 401ILE A 439GLY A 277ILE A 261 | None | 1.00A | 3ekqB-1ddgA:undetectable | 3ekqB-1ddgA:15.12 | ||
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. | 1dkd | GROEL (Escherichiacoli) |
PF00118(Cpn60_TCP1) | 5 | LEU A 222VAL A 276ILE A 325PRO A 279ILE A 250 | None | 1.03A | 3ekqB-1dkdA:undetectable | 3ekqB-1dkdA:25.83 | ||
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. | 1ece | ENDOCELLULASE E1 (Acidothermuscellulolyticus) |
PF00150(Cellulase) | 5 | ILE A 23GLY A 25ILE A 26PRO A 64ILE A 111 | None | 1.14A | 3ekqB-1eceA:undetectable | 3ekqB-1eceA:13.24 | ||
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. | 1f8r | L-AMINO ACID OXIDASE (Calloselasmarhodostoma) |
PF01593(Amino_oxidase) | 5 | LEU A 207VAL A 200ILE A 190GLY A 193ILE A 203 | None | 1.13A | 3ekqB-1f8rA:undetectable | 3ekqB-1f8rA:13.33 | ||
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. | 1fcd | FLAVOCYTOCHROME CSULFIDEDEHYDROGENASE(FLAVIN-BINDINGSUBUNIT) (Allochromatiumvinosum) |
PF07992(Pyr_redox_2)PF09242(FCSD-flav_bind) | 5 | ASP A 75VAL A 8ILE A 261GLY A 79ILE A 33 | NoneFAD A 699 (-4.3A)FAD A 699 (-3.7A)NoneFAD A 699 (-4.7A) | 1.00A | 3ekqB-1fcdA:undetectable | 3ekqB-1fcdA:13.75 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 1hvc | HIV-1 PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 9 | ARG A 8LEU A 23ASP A 25VAL A 32ILE A 47GLY A 49ILE A 50PRO A 81ILE A 84 | A79 A 800 (-3.4A)A79 A 800 ( 3.8A)A79 A 800 (-2.7A)A79 A 800 ( 4.4A)A79 A 800 ( 3.2A)A79 A 800 ( 3.7A)A79 A 800 (-3.8A)A79 A 800 ( 3.9A)A79 A 800 (-3.6A) | 0.60A | 3ekqB-1hvcA:14.2 | 3ekqB-1hvcA:46.31 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 1hvc | HIV-1 PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 9 | ARG A 8LEU A 23ASP A 25VAL A 32ILE A 47GLY A 49ILE A 50PRO A 81ILE A 84 | A79 A 800 (-3.6A)A79 A 800 ( 4.0A)A79 A 800 (-2.8A)A79 A 800 ( 4.3A)A79 A 800 ( 3.4A)A79 A 800 (-3.4A)A79 A 800 ( 4.0A)A79 A 800 ( 3.4A)A79 A 800 (-3.8A) | 0.66A | 3ekqB-1hvcA:14.2 | 3ekqB-1hvcA:46.31 | ||
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. | 1jqe | HISTAMINEN-METHYLTRANSFERASE (Homo sapiens) |
PF13489(Methyltransf_23) | 5 | LEU A 71ASP A 67ILE A 171ILE A 59ILE A 70 | None | 1.00A | 3ekqB-1jqeA:undetectable | 3ekqB-1jqeA:14.98 | ||
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. | 1lk5 | D-RIBOSE-5-PHOSPHATEISOMERASE (Pyrococcushorikoshii) |
PF06026(Rib_5-P_isom_A) | 5 | LEU A 161ILE A 200GLY A 202ILE A 141ILE A 180 | None | 0.98A | 3ekqB-1lk5A:undetectable | 3ekqB-1lk5A:20.52 | ||
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. | 1mro | METHYL-COENZYME MREDUCTASE (Methanothermobactermarburgensis) |
PF02249(MCR_alpha)PF02745(MCR_alpha_N) | 5 | LEU A 120VAL A 124ILE A 129ILE A 231ILE A 116 | None | 1.14A | 3ekqB-1mroA:undetectable | 3ekqB-1mroA:10.26 | ||
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. | 1poi | GLUTACONATE COENZYMEA-TRANSFERASE (Acidaminococcusfermentans) |
PF01144(CoA_trans) | 5 | VAL B 27ILE B 21GLY B 37ILE B 36ILE B 51 | None | 1.03A | 3ekqB-1poiB:undetectable | 3ekqB-1poiB:19.02 | ||
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. | 1rfz | HYPOTHETICAL PROTEINAPC35681 (Geobacillusstearothermophilus) |
PF04608(PgpA) | 5 | LEU A 157VAL A 54ILE A 104GLY A 147ILE A 119 | None | 1.11A | 3ekqB-1rfzA:undetectable | 3ekqB-1rfzA:19.41 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 1siv | SIV PROTEASE (Simianimmunodeficiencyvirus) |
PF00077(RVP) | 7 | ARG A 8LEU A 23ASP A 25GLY A 49ILE A 50PRO A 81ILE A 84 | None | 0.80A | 3ekqB-1sivA:18.1 | 3ekqB-1sivA:48.48 | ||
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. | 1sr8 | COBALAMINBIOSYNTHESIS PROTEIN(CBID) (Archaeoglobusfulgidus) |
PF01888(CbiD) | 5 | LEU A 243ASP A 240ILE A 260GLY A 263ILE A 239 | None | 1.09A | 3ekqB-1sr8A:undetectable | 3ekqB-1sr8A:16.05 | ||
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. | 1su7 | CARBON MONOXIDEDEHYDROGENASE 2 (Carboxydothermushydrogenoformans) |
PF03063(Prismane) | 5 | VAL A 270ILE A 306GLY A 292ILE A 293ILE A 269 | None | 1.10A | 3ekqB-1su7A:undetectable | 3ekqB-1su7A:9.89 | ||
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. | 1vq0 | 33 KDA CHAPERONIN (Thermotogamaritima) |
PF01430(HSP33) | 5 | LEU A 94ASP A 103VAL A 39ILE A 136GLY A 134 | None | 1.06A | 3ekqB-1vq0A:undetectable | 3ekqB-1vq0A:17.23 | ||
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. | 1vzo | RIBOSOMAL PROTEIN S6KINASE ALPHA 5 (Homo sapiens) |
PF00069(Pkinase) | 5 | VAL A 331ILE A 321GLY A 159ILE A 161PRO A 334 | None | 1.12A | 3ekqB-1vzoA:undetectable | 3ekqB-1vzoA:15.21 | ||
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. | 1y9i | LOW TEMPERATUREREQUIREMENT CPROTEIN (Listeriamonocytogenes) |
PF04608(PgpA) | 5 | LEU A 158VAL A 55ILE A 105GLY A 148ILE A 120 | None | 1.12A | 3ekqB-1y9iA:undetectable | 3ekqB-1y9iA: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. | 1zsq | MYOTUBULARIN-RELATEDPROTEIN 2 (Homo sapiens) |
PF02893(GRAM)PF06602(Myotub-related) | 5 | LEU A 348VAL A 414ILE A 306PRO A 287ILE A 318 | None | 1.12A | 3ekqB-1zsqA:undetectable | 3ekqB-1zsqA:11.23 | ||
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. | 2afv | COBALAMINBIOSYNTHESISPRECORRIN ISOMERASE (Leptospirainterrogans) |
PF02570(CbiC) | 5 | ILE A 194GLY A 165ILE A 139PRO A 160ILE A 136 | None | 0.88A | 3ekqB-2afvA:undetectable | 3ekqB-2afvA:19.48 | ||
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. | 2bb0 | IMIDAZOLONEPROPIONASE (Bacillussubtilis) |
PF01979(Amidohydro_1) | 5 | LEU A 374VAL A 48ILE A 5ILE A 65ILE A 47 | None | 1.13A | 3ekqB-2bb0A:undetectable | 3ekqB-2bb0A:13.53 | ||
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. | 2cev | PROTEIN (ARGINASE) ([Bacillus]caldovelox) |
PF00491(Arginase) | 5 | LEU A 46ILE A 101GLY A 104PRO A 92ILE A 7 | None | 0.99A | 3ekqB-2cevA:undetectable | 3ekqB-2cevA:17.60 | ||
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. | 2cl2 | PUTATIVELAMINARINASE (Phanerochaetechrysosporium) |
no annotation | 5 | LEU A 52VAL A 89ILE A 119ILE A 248ILE A 291 | None | 1.00A | 3ekqB-2cl2A:undetectable | 3ekqB-2cl2A:18.85 | ||
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. | 2f2l | PEPTIDOGLYCAN-RECOGNITION PROTEIN-LCISOFORM LCA (Drosophilamelanogaster) |
PF01510(Amidase_2) | 5 | LEU A 403ASP A 407ILE A 370GLY A 438ILE A 416 | None | 1.06A | 3ekqB-2f2lA:undetectable | 3ekqB-2f2lA:19.64 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2fmb | EQUINE INFECTIOUSANEMIA VIRUSPROTEASE (Equineinfectiousanemia virus) |
PF00077(RVP) | 8 | ARG A 8LEU A 23ASP A 25VAL A 32ILE A 53GLY A 55PRO A 86ILE A 89 | LP1 A 201 (-3.5A)NoneLP1 A 201 (-2.3A)NoneLP1 A 201 (-4.6A)LP1 A 201 (-3.4A)LP1 A 201 (-3.9A)LP1 A 201 (-4.2A) | 0.65A | 3ekqB-2fmbA:14.9 | 3ekqB-2fmbA:31.73 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2fmb | EQUINE INFECTIOUSANEMIA VIRUSPROTEASE (Equineinfectiousanemia virus) |
PF00077(RVP) | 5 | ASP A 25VAL A 32GLY A 54PRO A 86ILE A 89 | LP1 A 201 (-2.3A)NoneLP1 A 201 (-3.6A)LP1 A 201 (-3.9A)LP1 A 201 (-4.2A) | 0.83A | 3ekqB-2fmbA:14.9 | 3ekqB-2fmbA:31.73 | ||
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. | 2fpq | BOTULINUM NEUROTOXIND LIGHT CHAIN (Clostridiumbotulinum) |
PF01742(Peptidase_M27) | 5 | LEU A 192VAL A 45ILE A 91ILE A 97ILE A 158 | None | 0.92A | 3ekqB-2fpqA:undetectable | 3ekqB-2fpqA:14.66 | ||
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. | 2izo | FLAPSTRUCTURE-SPECIFICENDONUCLEASE (Sulfolobussolfataricus) |
PF00752(XPG_N)PF00867(XPG_I) | 5 | ARG A 183ILE A 224GLY A 227ILE A 230ILE A 174 | None | 1.10A | 3ekqB-2izoA:undetectable | 3ekqB-2izoA:14.15 | ||
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. | 2j22 | FUCOLECTIN-RELATEDPROTEIN (Streptococcuspneumoniae) |
PF00754(F5_F8_type_C) | 5 | LEU A 115VAL A 143ILE A 63ILE A 93ILE A 76 | None | 1.12A | 3ekqB-2j22A:undetectable | 3ekqB-2j22A:17.56 | ||
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. | 2j3r | ZGC 92866 (Danio rerio) |
PF04051(TRAPP) | 5 | LEU B 86VAL B 93ILE B 146GLY B 144ILE B 89 | None | 1.11A | 3ekqB-2j3rB:undetectable | 3ekqB-2j3rB:22.64 | ||
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. | 2j3w | ZGC 92866 (Danio rerio) |
PF04051(TRAPP) | 5 | LEU B 86VAL B 93ILE B 146GLY B 144ILE B 89 | None | 1.08A | 3ekqB-2j3wB:undetectable | 3ekqB-2j3wB:20.79 | ||
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. | 2lnv | GENERAL SECRETIONPATHWAY PROTEIN C (Dickeyadadantii) |
PF11356(T2SSC) | 5 | LEU A 145ILE A 110GLY A 99PRO A 129ILE A 135 | None | 1.08A | 3ekqB-2lnvA:undetectable | 3ekqB-2lnvA: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. | 2ma4 | PUTATIVE PERIPLASMICPROTEIN (Salmonellaenterica) |
PF07338(DUF1471) | 5 | VAL A 70ILE A 43GLY A 83ILE A 81ILE A 24 | None | 1.11A | 3ekqB-2ma4A:undetectable | 3ekqB-2ma4A: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. | 2pyx | TRYPTOPHANHALOGENASE (Shewanellafrigidimarina) |
PF04820(Trp_halogenase) | 5 | LEU A 42VAL A 190GLY A 18ILE A 349ILE A 44 | None | 0.90A | 3ekqB-2pyxA:undetectable | 3ekqB-2pyxA:10.96 | ||
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. | 2qps | ALPHA-AMYLASE TYPE AISOZYME (Hordeum vulgare) |
PF00128(Alpha-amylase)PF07821(Alpha-amyl_C2) | 5 | LEU A 354VAL A 372ILE A 342ILE A 313ILE A 368 | None | 1.11A | 3ekqB-2qpsA:undetectable | 3ekqB-2qpsA:13.32 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2rkf | PROTEASE RETROPEPSIN (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 7 | ARG A 8LEU A 23ASP A 25GLY A 49ILE A 50PRO A 81ILE A 84 | AB1 A 501 ( 4.7A)NoneAB1 A 501 (-2.4A)AB1 A 501 (-3.5A)AB1 A 501 (-3.8A)AB1 A 501 (-4.2A)AB1 A 501 ( 4.2A) | 0.54A | 3ekqB-2rkfA:20.1 | 3ekqB-2rkfA:81.82 | ||
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. | 2vca | ALPHA-N-ACETYLGLUCOSAMINIDASE (Clostridiumperfringens) |
PF00754(F5_F8_type_C)PF05089(NAGLU)PF12971(NAGLU_N)PF12972(NAGLU_C) | 5 | VAL A 152ILE A 132GLY A 130ILE A 74ILE A 29 | None | 1.12A | 3ekqB-2vcaA:undetectable | 3ekqB-2vcaA:7.38 | ||
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. | 2vd3 | ATPPHOSPHORIBOSYLTRANSFERASE (Methanothermobacterthermautotrophicus) |
PF01634(HisG)PF08029(HisG_C) | 5 | LEU A 66VAL A 7ILE A 18GLY A 27ILE A 5 | NoneNoneNone MG A1296 (-3.5A)None | 1.11A | 3ekqB-2vd3A:undetectable | 3ekqB-2vd3A:16.03 | ||
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. | 2whl | BETA-MANNANASE (Salipaludibacillusagaradhaerens) |
PF00150(Cellulase) | 5 | LEU A 157VAL A 85ILE A 69ILE A 107ILE A 122 | None | 1.06A | 3ekqB-2whlA:undetectable | 3ekqB-2whlA:15.65 | ||
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. | 2whl | BETA-MANNANASE (Salipaludibacillusagaradhaerens) |
PF00150(Cellulase) | 5 | LEU A 157VAL A 85ILE A 73ILE A 114ILE A 122 | None | 0.95A | 3ekqB-2whlA:undetectable | 3ekqB-2whlA:15.65 | ||
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. | 2xbl | PHOSPHOHEPTOSEISOMERASE (Burkholderiapseudomallei) |
PF13580(SIS_2) | 5 | ARG A 157LEU A 163VAL A 33GLY A 177ILE A 174 | None | 1.00A | 3ekqB-2xblA:undetectable | 3ekqB-2xblA:19.49 | ||
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. | 2zz8 | LIPL32 PROTEIN (Leptospirainterrogans) |
PF12103(Lipl32) | 5 | LEU A 63VAL A 118ILE A 165GLY A 75ILE A 193 | None | 0.90A | 3ekqB-2zz8A:undetectable | 3ekqB-2zz8A: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. | 3adp | LAMBDA-CRYSTALLIN (Oryctolaguscuniculus) |
PF00725(3HCDH)PF02737(3HCDH_N) | 5 | ARG A 50LEU A 72VAL A 32GLY A 18ILE A 75 | None | 1.00A | 3ekqB-3adpA:undetectable | 3ekqB-3adpA:15.41 | ||
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. | 3al0 | GLUTAMYL-TRNA(GLN)AMIDOTRANSFERASESUBUNIT A (Thermotogamaritima) |
PF01425(Amidase) | 5 | VAL A 94ILE A 69GLY A 159ILE A 203ILE A 217 | None | 1.11A | 3ekqB-3al0A:undetectable | 3ekqB-3al0A:13.84 | ||
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. | 3cp8 | TRNA URIDINE5-CARBOXYMETHYLAMINOMETHYL MODIFICATIONENZYME GIDA (Chlorobaculumtepidum) |
PF01134(GIDA)PF13932(GIDA_assoc) | 5 | LEU A 116ASP A 118VAL A 7GLY A 122ILE A 30 | None | 0.92A | 3ekqB-3cp8A:undetectable | 3ekqB-3cp8A:9.90 | ||
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. | 3f3k | UNCHARACTERIZEDPROTEIN YKR043C (Saccharomycescerevisiae) |
PF00300(His_Phos_1) | 5 | ARG A 181VAL A 173ILE A 155ILE A 186ILE A 10 | None | 0.98A | 3ekqB-3f3kA:undetectable | 3ekqB-3f3kA:17.31 | ||
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. | 3f3s | LAMBDA-CRYSTALLINHOMOLOG (Homo sapiens) |
PF00725(3HCDH)PF02737(3HCDH_N) | 5 | ARG A 50LEU A 72VAL A 32GLY A 18ILE A 75 | None | 1.02A | 3ekqB-3f3sA:undetectable | 3ekqB-3f3sA:14.75 | ||
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. | 3fed | GLUTAMATECARBOXYPEPTIDASE III (Homo sapiens) |
PF02225(PA)PF04253(TFR_dimer)PF04389(Peptidase_M28) | 5 | ARG A 517LEU A 518ILE A 440GLY A 365ILE A 520 | None | 1.12A | 3ekqB-3fedA:undetectable | 3ekqB-3fedA:10.07 | ||
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. | 3jug | BETA-MANNANASE (Bacillus sp.N16-5) |
PF00150(Cellulase) | 5 | LEU A 188VAL A 116ILE A 104ILE A 145ILE A 153 | None | 0.95A | 3ekqB-3jugA:undetectable | 3ekqB-3jugA:15.50 | ||
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. | 3kve | L-AMINO ACID OXIDASE (Viperaammodytes) |
PF01593(Amino_oxidase) | 5 | LEU A 207VAL A 200ILE A 190GLY A 193ILE A 203 | None | 1.11A | 3ekqB-3kveA:undetectable | 3ekqB-3kveA:12.37 | ||
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. | 3lov | PROTOPORPHYRINOGENOXIDASE (Exiguobacteriumsibiricum) |
PF01593(Amino_oxidase) | 5 | LEU A 387VAL A 358ILE A 54ILE A 402PRO A 397 | None | 1.11A | 3ekqB-3lovA:undetectable | 3ekqB-3lovA:13.39 | ||
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. | 3mwe | ATP-CITRATE SYNTHASE (Homo sapiens) |
PF16114(Citrate_bind) | 5 | LEU A 217VAL A 121ILE A 185GLY A 187ILE A 202 | None | 1.12A | 3ekqB-3mweA:undetectable | 3ekqB-3mweA:11.89 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3mws | HIV-1 PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 5 | ARG A 8LEU A 23VAL A 32ILE A 50PRO A 81 | None | 0.95A | 3ekqB-3mwsA:19.2 | 3ekqB-3mwsA:74.75 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3mws | HIV-1 PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 8 | LEU A 23ASP A 25VAL A 32ILE A 47GLY A 49ILE A 50PRO A 81ILE A 84 | None | 0.63A | 3ekqB-3mwsA:19.2 | 3ekqB-3mwsA:74.75 | ||
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. | 3r9u | THIOREDOXINREDUCTASE (Campylobacterjejuni) |
PF07992(Pyr_redox_2) | 5 | LEU A 14VAL A 290ILE A 46GLY A 58ILE A 59 | NoneFAD A 501 (-4.0A)FAD A 501 (-4.3A)NoneNone | 0.92A | 3ekqB-3r9uA:undetectable | 3ekqB-3r9uA:14.57 | ||
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. | 3rg9 | BIFUNCTIONALDIHYDROFOLATEREDUCTASE-THYMIDYLATE SYNTHASE (Trypanosomabrucei) |
PF00186(DHFR_1) | 5 | ARG A 214LEU A 236VAL A 33ILE A 41GLY A 39 | NoneNoneNDP A 601 ( 3.8A)NDP A 601 (-3.5A)None | 1.08A | 3ekqB-3rg9A:undetectable | 3ekqB-3rg9A:17.87 | ||
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. | 3rh8 | VIVID PAS PROTEINVVD (Neurosporacrassa) |
PF13426(PAS_9) | 5 | ARG B 109VAL B 145GLY B 180ILE B 74ILE B 135 | FAD B5201 (-4.3A)NoneFAD B5201 (-3.8A)FAD B5201 (-4.9A)FAD B5201 ( 4.4A) | 1.13A | 3ekqB-3rh8B:undetectable | 3ekqB-3rh8B:23.29 | ||
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. | 3rim | TRANSKETOLASE (Mycobacteriumtuberculosis) |
PF00456(Transketolase_N)PF02779(Transket_pyr)PF02780(Transketolase_C) | 5 | ARG A 150ILE A 130GLY A 450ILE A 451ILE A 171 | None | 1.11A | 3ekqB-3rimA:undetectable | 3ekqB-3rimA:10.13 | ||
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. | 3slz | GAG-PRO-POLPOLYPROTEIN (Murine leukemiavirus) |
PF00077(RVP) | 5 | LEU A 30ASP A 32VAL A 39GLY A 56PRO A 89 | None3TL A 126 (-2.4A)None3TL A 126 (-3.4A)3TL A 126 (-4.0A) | 0.88A | 3ekqB-3slzA:11.3 | 3ekqB-3slzA:26.67 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3t3c | HIV-1 PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 6 | LEU A 23ASP A 25VAL A 32ILE A 47GLY A 49ILE A 50 | SO4 A 101 (-4.2A)017 A 201 (-2.6A)NoneNone017 A 201 (-4.0A)017 A 201 (-3.3A) | 0.47A | 3ekqB-3t3cA:18.4 | 3ekqB-3t3cA:78.79 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3t3c | HIV-1 PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 6 | LEU A 23ASP A 25VAL A 32ILE A 47GLY A 49PRO A 81 | SO4 A 101 (-4.2A)017 A 201 (-2.6A)NoneNone017 A 201 (-4.0A)None | 0.75A | 3ekqB-3t3cA:18.4 | 3ekqB-3t3cA:78.79 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3ttp | HIV-1 PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 7 | ARG A 8LEU A 23ASP A 25GLY A 49ILE A 50PRO A 81ILE A 84 | 017 A 201 ( 4.8A)None017 A 201 (-2.6A)017 A 201 (-3.0A)017 A 201 (-3.3A)017 A 201 (-4.1A)017 A 201 (-4.7A) | 0.61A | 3ekqB-3ttpA:19.1 | 3ekqB-3ttpA:77.78 | ||
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. | 3u24 | PUTATIVE LIPOPROTEIN (Shewanellaoneidensis) |
PF05960(DUF885) | 5 | LEU A 567VAL A 351ILE A 430GLY A 432ILE A 356 | None | 1.05A | 3ekqB-3u24A:undetectable | 3ekqB-3u24A:11.50 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3u7s | POL POLYPROTEIN (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 7 | ARG A 8LEU A 23ASP A 25ILE A 47GLY A 49ILE A 50PRO A 81 | NoneNone017 A 202 ( 2.5A)017 A 202 (-3.6A)017 A 202 (-2.9A)017 A 201 ( 3.5A)017 A 202 (-4.0A) | 0.64A | 3ekqB-3u7sA:19.6 | 3ekqB-3u7sA:76.77 | ||
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. | 3wn6 | ALPHA-AMYLASE (Oryza sativa) |
PF00128(Alpha-amylase)PF07821(Alpha-amyl_C2) | 5 | LEU A 377VAL A 395ILE A 365ILE A 336ILE A 391 | None | 1.02A | 3ekqB-3wn6A:undetectable | 3ekqB-3wn6A:13.88 | ||
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. | 4a2l | TWO-COMPONENT SYSTEMSENSOR HISTIDINEKINASE/RESPONSE (Bacteroidesthetaiotaomicron) |
PF07494(Reg_prop)PF07495(Y_Y_Y) | 5 | ARG A 505VAL A 558GLY A 515ILE A 500ILE A 548 | None | 0.95A | 3ekqB-4a2lA:undetectable | 3ekqB-4a2lA:8.85 | ||
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. | 4emk | U6 SNRNA-ASSOCIATEDSM-LIKE PROTEIN LSM5U6 SNRNA-ASSOCIATEDSM-LIKE PROTEIN LSM7 (Schizosaccharomycespombe) |
PF01423(LSM) | 5 | LEU A 10VAL C 88ILE C 46GLY C 48ILE C 49 | None | 1.09A | 3ekqB-4emkA:undetectable | 3ekqB-4emkA: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. | 4f4o | HAPTOGLOBIN (Sus scrofa) |
PF00089(Trypsin) | 5 | LEU C 138VAL C 177ILE C 158ILE C 121ILE C 191 | None | 1.05A | 3ekqB-4f4oC:undetectable | 3ekqB-4f4oC:18.79 | ||
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. | 4fx5 | VON WILLEBRANDFACTOR TYPE A (Catenulisporaacidiphila) |
PF13768(VWA_3) | 5 | LEU A 161VAL A 96ILE A 148GLY A 146ILE A 59 | None | 1.06A | 3ekqB-4fx5A:undetectable | 3ekqB-4fx5A:13.72 | ||
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. | 4jwy | GLUTAMATE RECEPTORIONOTROPIC, NMDA 2D (Rattusnorvegicus) |
PF10613(Lig_chan-Glu_bd) | 5 | LEU A 264ASP A 260ILE A 112GLY A 246ILE A 117 | None | 1.02A | 3ekqB-4jwyA:undetectable | 3ekqB-4jwyA:18.42 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4njv | PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 9 | ARG A 8LEU A 23ASP A 25VAL A 32ILE A 47GLY A 49ILE A 50PRO A 81ILE A 84 | RIT A 500 (-3.2A)NoneRIT A 500 (-2.4A)NoneRIT A 500 ( 4.5A)RIT A 500 (-3.4A)RIT A 500 (-4.3A)RIT A 500 (-3.9A)RIT A 500 (-4.3A) | 0.63A | 3ekqB-4njvA:20.1 | 3ekqB-4njvA:87.88 | ||
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. | 4nky | STEROID17-ALPHA-HYDROXYLASE/17,20 LYASE (Homo sapiens) |
PF00067(p450) | 5 | LEU A 396VAL A 76ILE A 381ILE A 87ILE A 394 | None | 0.97A | 3ekqB-4nkyA:undetectable | 3ekqB-4nkyA:12.55 | ||
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. | 4pyr | PUTATIVEBRANCHED-CHAIN AMINOACID ABC TRANSPORTER (Chromobacteriumviolaceum) |
PF04348(LppC) | 5 | LEU A 166VAL A 88GLY A 107ILE A 337ILE A 146 | None | 0.80A | 3ekqB-4pyrA:undetectable | 3ekqB-4pyrA:14.52 | ||
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. | 4qex | ERYTHROCYTE-BINDINGANTIGEN-175 (Plasmodiumfalciparum) |
PF05424(Duffy_binding) | 5 | ARG A 348LEU A 383VAL A 323ILE A 375ILE A 382 | None | 1.07A | 3ekqB-4qexA:undetectable | 3ekqB-4qexA:10.33 | ||
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. | 4xa9 | GALA PROTEIN TYPE 1,3 OR 4 (Legionellapneumophila) |
PF13516(LRR_6) | 5 | LEU A 49VAL A 97ILE A 102GLY A 82ILE A 73 | None | 0.91A | 3ekqB-4xa9A:undetectable | 3ekqB-4xa9A: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. | 4y2w | ALANINE RACEMASE 1 (Caldanaerobactersubterraneus) |
PF00842(Ala_racemase_C)PF01168(Ala_racemase_N) | 5 | VAL A 51ILE A 39GLY A 226ILE A 228ILE A 18 | NoneNonePO4 A 401 (-3.7A)NoneNone | 1.13A | 3ekqB-4y2wA:undetectable | 3ekqB-4y2wA:15.17 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4ydf | HTLV-1 PROTEASE (PrimateT-lymphotropicvirus 1) |
PF00077(RVP) | 6 | ARG A 10LEU A 30ASP A 32VAL A 39GLY A 58ILE A 100 | NoneNone4B1 A 201 (-2.9A)None4B1 A 201 (-3.4A)4B1 A 201 (-4.8A) | 0.74A | 3ekqB-4ydfA:12.9 | 3ekqB-4ydfA:32.48 | ||
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. | 4ywl | CELL DIVISIONCONTROL PROTEIN 21 (Pyrococcusfuriosus) |
PF14551(MCM_N)PF17207(MCM_OB) | 5 | VAL A 221ILE A 187GLY A 205ILE A 206ILE A 249 | None | 1.05A | 3ekqB-4ywlA:undetectable | 3ekqB-4ywlA:19.35 | ||
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. | 5bqn | BOTULINUM NEUROTOXINTYPE D,BOTULINUMNEUROTOXIN TYPE D (Clostridiumbotulinum) |
PF01742(Peptidase_M27)PF07952(Toxin_trans) | 5 | LEU A 192VAL A 45ILE A 91ILE A 97ILE A 158 | None | 0.95A | 3ekqB-5bqnA:undetectable | 3ekqB-5bqnA:9.01 | ||
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. | 5c16 | MYOTUBULARIN-RELATEDPROTEIN 1 (Homo sapiens) |
PF02893(GRAM)PF06602(Myotub-related) | 5 | LEU A 369VAL A 435ILE A 327PRO A 308ILE A 339 | None | 1.12A | 3ekqB-5c16A:undetectable | 3ekqB-5c16A:9.52 | ||
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. | 5cw5 | BRCA1/BRCA2-CONTAINING COMPLEX SUBUNIT 3 (Camponotusfloridanus) |
PF01398(JAB) | 5 | LEU A 79VAL A 89GLY A 33ILE A 51ILE A 36 | None | 0.99A | 3ekqB-5cw5A:undetectable | 3ekqB-5cw5A:16.08 | ||
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. | 5ihe | DNA POLYMERASE IISMALL SUBUNIT (Pyrococcusabyssi) |
PF00149(Metallophos) | 5 | LEU A 488VAL A 199GLY A 447ILE A 401ILE A 486 | None | 1.03A | 3ekqB-5iheA:undetectable | 3ekqB-5iheA:12.69 | ||
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. | 5l6s | GLUCOSE-1-PHOSPHATEADENYLYLTRANSFERASE (Escherichiacoli) |
PF00483(NTP_transferase) | 5 | LEU A 139VAL A 71ILE A 84ILE A 62ILE A 24 | None | 1.05A | 3ekqB-5l6sA:undetectable | 3ekqB-5l6sA:11.78 | ||
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. | 5lcn | UNCHARACTERIZEDPROTEIN (Pyrococcusfuriosus) |
PF12146(Hydrolase_4) | 5 | LEU A 159VAL A 214ILE A 175ILE A 228ILE A 156 | None | 1.05A | 3ekqB-5lcnA:undetectable | 3ekqB-5lcnA: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. | 5mu3 | CENTRAL KINETOCHORESUBUNIT MCM21 (Kluyveromyceslactis) |
no annotation | 5 | LEU A 124VAL A 155ILE A 180ILE A 187ILE A 137 | None | 0.92A | 3ekqB-5mu3A:undetectable | 3ekqB-5mu3A: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. | 5n28 | METHYL-COENZYME MREDUCTASE, BETASUBUNIT (Methanotorrisformicicus) |
PF02241(MCR_beta)PF02783(MCR_beta_N) | 5 | LEU B 238ILE B 434GLY B 436PRO B 23ILE B 27 | None | 1.09A | 3ekqB-5n28B:undetectable | 3ekqB-5n28B:14.22 | ||
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. | 5o1p | ALPHA-AMINOADIPICSEMIALDEHYDESYNTHASE,MITOCHONDRIAL (Homo sapiens) |
PF03435(Sacchrp_dh_NADP)PF16653(Sacchrp_dh_C) | 5 | LEU A 815VAL A 738ILE A 680GLY A 678ILE A 743 | None | 1.09A | 3ekqB-5o1pA:undetectable | 3ekqB-5o1pA:12.47 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 5t2z | PROTEASE (Humanimmunodeficiencyvirus 1) |
PF00077(RVP) | 9 | ARG A 8LEU A 23ASP A 25VAL A 32ILE A 47GLY A 49ILE A 50PRO A 81ILE A 84 | None | 0.59A | 3ekqB-5t2zA:19.6 | 3ekqB-5t2zA:81.82 | ||
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. | 5tc4 | BIFUNCTIONALMETHYLENETETRAHYDROFOLATEDEHYDROGENASE/CYCLOHYDROLASE,MITOCHONDRIAL (Homo sapiens) |
PF00763(THF_DHG_CYH)PF02882(THF_DHG_CYH_C) | 5 | LEU A 45VAL A 180ILE A 251ILE A 305ILE A 183 | None | 1.09A | 3ekqB-5tc4A:undetectable | 3ekqB-5tc4A:14.51 | ||
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. | 5te1 | ATP-CITRATE SYNTHASE (Homo sapiens) |
PF00549(Ligase_CoA)PF02629(CoA_binding)PF16114(Citrate_bind) | 5 | LEU A 217VAL A 121ILE A 185GLY A 187ILE A 202 | None | 1.14A | 3ekqB-5te1A:undetectable | 3ekqB-5te1A:8.92 | ||
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. | 5u03 | CTP SYNTHASE 1 (Homo sapiens) |
PF00117(GATase)PF06418(CTP_synth_N) | 5 | LEU A 213VAL A 6GLY A 24ILE A 26ILE A 178 | None | 1.10A | 3ekqB-5u03A:undetectable | 3ekqB-5u03A:9.40 | ||
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. | 5ur0 | GLYCERALDEHYDE-3-PHOSPHATE DEHYDROGENASE (Naegleriagruberi) |
no annotation | 5 | VAL A 28ILE A 31GLY A 13ILE A 12ILE A 4 | NoneNoneNoneNAD A 401 (-4.1A)None | 0.94A | 3ekqB-5ur0A:undetectable | 3ekqB-5ur0A:20.91 | ||
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. | 5w0s | 60 KDA CHAPERONIN (Escherichiacoli) |
PF00118(Cpn60_TCP1) | 5 | LEU A 222VAL A 276ILE A 325PRO A 279ILE A 250 | None | 0.98A | 3ekqB-5w0sA:undetectable | 3ekqB-5w0sA:10.81 | ||
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. | 5wgx | FLAVIN-DEPENDENTHALOGENASE (Malbrancheaaurantiaca) |
PF04820(Trp_halogenase) | 5 | LEU A 64VAL A 160GLY A 49ILE A 397ILE A 66 | None | 0.92A | 3ekqB-5wgxA:undetectable | 3ekqB-5wgxA:9.84 | ||
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. | 5wvr | KLLA0C04147P (Kluyveromyceslactis) |
PF01237(Oxysterol_BP) | 5 | VAL A 909ILE A1041GLY A1058ILE A1070ILE A 906 | None | 1.11A | 3ekqB-5wvrA:undetectable | 3ekqB-5wvrA:11.95 | ||
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. | 5y7y | ARYL HYDROCARBONRECEPTOR NUCLEARTRANSLOCATOR (Bos taurus) |
PF00010(HLH)PF00989(PAS)PF14598(PAS_11) | 5 | LEU B 423VAL B 416ILE B 369GLY B 371ILE B 396 | None | 1.09A | 3ekqB-5y7yB:undetectable | 3ekqB-5y7yB:16.13 | ||
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. | 6ej2 | BETA-SECRETASE 1 (Homo sapiens) |
no annotation | 5 | LEU A 694VAL A 779GLY A 762ILE A 761ILE A 707 | None | 1.07A | 3ekqB-6ej2A:6.2 | 3ekqB-6ej2A:22.00 | ||
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. | 6fml | INO80 (Chaetomiumthermophilum) |
no annotation | 5 | LEU G1190ILE G 991GLY G 993ILE G 994ILE G1193 | None | 1.13A | 3ekqB-6fmlG:undetectable | 3ekqB-6fmlG:21.36 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 6upj | HIV-2 PROTEASE (Humanimmunodeficiencyvirus 2) |
PF00077(RVP) | 5 | ARG A 8ASP A 25GLY A 49ILE A 50ILE A 84 | NoneNIU A 100 (-2.8A)NIU A 100 ( 3.8A)NIU A 100 (-3.9A)None | 0.82A | 3ekqB-6upjA:17.5 | 3ekqB-6upjA:47.47 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 6upj | HIV-2 PROTEASE (Humanimmunodeficiencyvirus 2) |
PF00077(RVP) | 6 | LEU A 23ASP A 25GLY A 49ILE A 50PRO A 81ILE A 84 | NoneNIU A 100 (-2.8A)NIU A 100 ( 3.8A)NIU A 100 (-3.9A)NoneNone | 0.82A | 3ekqB-6upjA:17.5 | 3ekqB-6upjA:47.47 |