Binding Sites are compared using Shaper.
For more information, please see the following publication:
Desaphy J. et al. Comparison and Druggability Prediction of protein-Ligand Binding sites from pharmacophore-annotated cavity shapes J. Chem. Inf. Model., 2012, 52(8), pp2287-2299
Binding Sites are considered as similar when the similarity value is greater than 0.44
PDB ID | HET | Uniprot Name | EC Number |
---|---|---|---|
1gul | GLY_GGL_ICY | Glutathione S-transferase A4 | 2.5.1.18 |
PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
---|---|---|---|---|---|
1gul | GLY_GGL_ICY | Glutathione S-transferase A4 | 2.5.1.18 | 1.000 | |
3ik7 | BOB | Glutathione S-transferase A4 | 2.5.1.18 | 0.546 | |
2r6k | GTX | Glutathione S-transferase A1 | 2.5.1.18 | 0.508 | |
1gsf | EAA | Glutathione S-transferase A1 | 2.5.1.18 | 0.502 | |
1dgh | NDP | Catalase | 1.11.1.6 | 0.501 | |
3dd0 | EZL | Carbonic anhydrase 2 | 4.2.1.1 | 0.492 | |
3ik9 | BOB | Glutathione S-transferase A1 | 2.5.1.18 | 0.492 | |
3sfh | 1DI | Histone deacetylase 8 | 3.5.1.98 | 0.481 | |
1b48 | HAG | Glutathione S-transferase A4 | 2.5.1.18 | 0.480 | |
3dgq | EAA | Glutathione S-transferase P | 2.5.1.18 | 0.478 | |
3ie3 | N11 | Glutathione S-transferase P | 2.5.1.18 | 0.478 | |
1kyx | CRM | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.475 | |
1dgg | NDP | Catalase | 1.11.1.6 | 0.473 | |
4gtt | 7TQ | Geranylgeranyl transferase type-2 subunit beta | 2.5.1.60 | 0.473 | |
4zzi | 1NS | NAD-dependent protein deacetylase sirtuin-1 | 3.5.1 | 0.473 | |
1aqv | 0HG | Glutathione S-transferase P | 2.5.1.18 | 0.472 | |
2xiq | 5AD | Methylmalonyl-CoA mutase, mitochondrial | / | 0.472 | |
1dgf | NDP | Catalase | 1.11.1.6 | 0.471 | |
2wn6 | NDP | ADP-ribosyltransferase enzymatic component | / | 0.471 | |
2q94 | A04 | Methionine aminopeptidase | / | 0.469 | |
4mvc | CDC | Choline-phosphate cytidylyltransferase A | / | 0.469 | |
1eno | NAD | Enoyl-[acyl-carrier-protein] reductase [NADH], chloroplastic | 1.3.1.9 | 0.468 | |
2ixk | TDO | dTDP-4-dehydrorhamnose 3,5-epimerase | 5.1.3.13 | 0.468 | |
3frk | TQP | QdtB | / | 0.468 | |
4cb6 | 29R | Polymerase basic protein 2 | / | 0.468 | |
1pq9 | 44B | Oxysterols receptor LXR-beta | / | 0.467 | |
2a58 | RBF | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.467 | |
1wl4 | COA | Acetyl-CoA acetyltransferase, cytosolic | 2.3.1.9 | 0.466 | |
1qs2 | NAD | Vip2Ac | / | 0.464 | |
2a2s | GSN | Glutathione S-transferase P | 2.5.1.18 | 0.464 | |
2ouy | CMP | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.463 | |
3gf4 | UPG | UDP-galactopyranose mutase | 5.4.99.9 | 0.463 | |
3mjr | AC2 | Deoxycytidine kinase | 2.7.1.74 | 0.463 | |
3nwl | NDP | Catalase | 1.11.1.6 | 0.463 | |
1obn | ASV | Isopenicillin N synthase | 1.21.3.1 | 0.462 | |
2w6c | BM4 | Acetylcholinesterase | 3.1.1.7 | 0.462 | |
3ktl | GTX | Glutathione S-transferase A1 | 2.5.1.18 | 0.462 | |
1enp | NAD | Enoyl-[acyl-carrier-protein] reductase [NADH], chloroplastic | 1.3.1.9 | 0.461 | |
1qti | GNT | Acetylcholinesterase | 3.1.1.7 | 0.461 | |
1u65 | CP0 | Acetylcholinesterase | 3.1.1.7 | 0.461 | |
3epy | COA | Acyl-CoA-binding domain-containing protein 7 | / | 0.460 | |
3fkt | SII | Beta-secretase 1 | 3.4.23.46 | 0.460 | |
3mj4 | URM | UDP-galactopyranose mutase | / | 0.460 | |
5c1g | GDU | Histo-blood group ABO system transferase | / | 0.460 | |
1pl6 | 572 | Sorbitol dehydrogenase | 1.1.1.14 | 0.459 | |
1tow | CRZ | Fatty acid-binding protein, adipocyte | / | 0.459 | |
2vd0 | D27 | Hematopoietic prostaglandin D synthase | / | 0.459 | |
1w4l | GL8 | Acetylcholinesterase | 3.1.1.7 | 0.458 | |
3ggs | 2FD | Purine nucleoside phosphorylase | 2.4.2.1 | 0.458 | |
3sff | 0DI | Histone deacetylase 8 | 3.5.1.98 | 0.458 | |
3sn7 | 540 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.458 | |
13gs | SAS | Glutathione S-transferase P | 2.5.1.18 | 0.457 | |
2jgs | BTN | Avidin | / | 0.457 | |
2cbr | A80 | Cellular retinoic acid-binding protein 1 | / | 0.456 | |
2vi5 | Y19 | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.456 | |
1aka | PLP | Aspartate aminotransferase, mitochondrial | 2.6.1.1 | 0.455 | |
1kbo | 340 | NAD(P)H dehydrogenase [quinone] 1 | 1.6.5.2 | 0.455 | |
1xp8 | AGS | Protein RecA | / | 0.455 | |
2r6j | NDP | Eugenol synthase 1 | 1.1.1.318 | 0.455 | |
4b6s | 2HN | 3-dehydroquinate dehydratase | 4.2.1.10 | 0.455 | |
1xr2 | C2F | 5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase | 2.1.1.14 | 0.454 | |
1bwl | FMN | NADPH dehydrogenase 1 | 1.6.99.1 | 0.453 | |
1fxu | GU7 | Purine nucleoside phosphorylase | 2.4.2.1 | 0.453 | |
1uhh | CZP | Aequorin-2 | / | 0.453 | |
3e34 | ED1 | Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha | / | 0.453 | |
3e34 | ED1 | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.453 | |
3h3t | 16H | Collagen type IV alpha-3-binding protein | / | 0.453 | |
4eqk | MGT | Polymerase basic protein 2 | / | 0.453 | |
4uy6 | SAH | Histidine N-alpha-methyltransferase | / | 0.453 | |
1tll | FMN | Nitric oxide synthase, brain | 1.14.13.39 | 0.452 | |
2our | CMP | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.452 | |
2ouu | 35G | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.452 | |
4bft | ZVT | Pantothenate kinase | 2.7.1.33 | 0.452 | |
4ey6 | GNT | Acetylcholinesterase | 3.1.1.7 | 0.452 | |
2pnc | CLU | Primary amine oxidase, liver isozyme | / | 0.451 | |
2xui | TZ5 | Acetylcholinesterase | 3.1.1.7 | 0.451 | |
3zoi | M2W | Isopenicillin N synthase | 1.21.3.1 | 0.451 | |
5fbh | TCR | Extracellular calcium-sensing receptor | / | 0.451 | |
2glr | GTX | Glutathione S-transferase P 1 | 2.5.1.18 | 0.450 | |
1yw8 | A75 | Methionine aminopeptidase 2 | / | 0.449 | |
3q44 | D50 | M1 family aminopeptidase | 3.4.11 | 0.449 | |
3zv7 | NHG | Acetylcholinesterase | 3.1.1.7 | 0.449 | |
4ifn | 12O | Kelch-like ECH-associated protein 1 | / | 0.449 | |
4nv1 | 0FX | Formyl transferase | / | 0.449 | |
1aqu | EST | Estrogen sulfotransferase, testis isoform | 2.8.2.4 | 0.448 | |
1dgb | NDP | Catalase | 1.11.1.6 | 0.448 | |
1o2g | 696 | Prothrombin | 3.4.21.5 | 0.448 | |
2a2d | ANP | N-acetylgalactosamine kinase | 2.7.1.157 | 0.448 | |
2ges | COK | Pantothenate kinase | 2.7.1.33 | 0.448 | |
3dzk | NMN | ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1 | 3.2.2.6 | 0.448 | |
3hl4 | CDC | Choline-phosphate cytidylyltransferase A | / | 0.448 | |
3sni | 546 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.448 | |
3v0o | 4GW | Histo-blood group ABO system transferase | / | 0.448 | |
4bfx | ZVX | Pantothenate kinase | 2.7.1.33 | 0.448 | |
4ge9 | 0L0 | Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial | 2.6.1.39 | 0.448 | |
4h6k | FMN | NADPH dehydrogenase 1 | 1.6.99.1 | 0.448 | |
2pk3 | A2R | GDP-6-deoxy-D-mannose reductase | / | 0.447 | |
4mlp | 2CX | Cryptochrome-2 | / | 0.447 | |
4wlj | IK2 | Kynurenine--oxoglutarate transaminase 1 | 2.6.1.7 | 0.447 | |
5c80 | URI | Uridine phosphorylase | / | 0.447 | |
1hb3 | SCV | Isopenicillin N synthase | 1.21.3.1 | 0.446 | |
1yry | MSG | Purine nucleoside phosphorylase | 2.4.2.1 | 0.446 | |
2oac | GTB | Glutathione S-transferase P 1 | 2.5.1.18 | 0.446 | |
2x0f | TRH | WsaF | / | 0.446 | |
3f8s | PF2 | Dipeptidyl peptidase 4 | / | 0.446 | |
4kp6 | 1S1 | cAMP-specific 3',5'-cyclic phosphodiesterase 4B | 3.1.4.53 | 0.446 | |
1gss | LEE | Glutathione S-transferase P | 2.5.1.18 | 0.445 | |
1jf0 | CZH | Obelin | / | 0.445 | |
1v3q | 2DI | Purine nucleoside phosphorylase | 2.4.2.1 | 0.445 | |
3dy8 | IBM | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.445 | |
3hdy | GDU | UDP-galactopyranose mutase | / | 0.445 | |
4bfs | ZVS | Pantothenate kinase | 2.7.1.33 | 0.445 | |
4jsr | 1NQ | NAD-dependent protein deacetylase sirtuin-3, mitochondrial | 3.5.1 | 0.445 | |
4xrb | NDP | Possible bifunctional enzyme riboflavin biosynthesis protein RibD: diaminohydroxyphosphoribosylaminopyrimidine deaminase (Riboflavin-specific deaminase) + 5-amino-6-(5-phosphoribosylamino)uracil reduc | / | 0.445 | |
1lv8 | 9PP | Purine nucleoside phosphorylase | 2.4.2.1 | 0.444 | |
1ps9 | MDE | 2,4-dienoyl-CoA reductase | 1.3.1.34 | 0.444 | |
2wo7 | ASV | Isopenicillin N synthase | 1.21.3.1 | 0.444 | |
3ugr | IMN | Aldo-keto reductase family 1 member C3 | / | 0.444 | |
1muu | GDX | GDP-mannose 6-dehydrogenase | 1.1.1.132 | 0.443 | |
1nhk | CMP | Nucleoside diphosphate kinase | 2.7.4.6 | 0.443 | |
1x1c | SAH | C-20 methyltransferase | / | 0.443 | |
2bjf | DXC | Choloylglycine hydrolase | 3.5.1.24 | 0.443 | |
3jsw | JAR | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.443 | |
3jun | AJD | Phenazine biosynthesis protein A/B | / | 0.443 | |
4fl0 | PLP | Aminotransferase ALD1, chloroplastic | 2.6.1 | 0.443 | |
1lnm | DTX | Bilin-binding protein | / | 0.442 | |
1oc1 | ASV | Isopenicillin N synthase | 1.21.3.1 | 0.442 | |
1x2h | LPA | Lipoate-protein ligase A | 6.3.1.20 | 0.442 | |
3hxc | BD6 | Geranylgeranyl transferase type-2 subunit beta | 2.5.1.60 | 0.442 | |
3nu0 | 3TU | Dihydrofolate reductase | 1.5.1.3 | 0.442 | |
3uzz | ASD | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.442 | |
4bfy | ZVY | Pantothenate kinase | 2.7.1.33 | 0.442 | |
4to2 | DGT | Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 | 3.1.5 | 0.442 | |
1pwy | AC2 | Purine nucleoside phosphorylase | 2.4.2.1 | 0.441 | |
1tg2 | H2B | Phenylalanine-4-hydroxylase | 1.14.16.1 | 0.441 | |
2c6c | 24I | Glutamate carboxypeptidase 2 | 3.4.17.21 | 0.441 | |
2cek | N8T | Acetylcholinesterase | 3.1.1.7 | 0.441 | |
2xb9 | XNW | 3-dehydroquinate dehydratase | 4.2.1.10 | 0.441 | |
3fr5 | I4A | Fatty acid-binding protein, adipocyte | / | 0.441 | |
4bfz | ZVZ | Pantothenate kinase | 2.7.1.33 | 0.441 | |
4dyp | 0MS | Nucleoprotein | / | 0.441 | |
4fcb | 0T7 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.441 | |
4nqg | CZH | Mitrocomin | / | 0.441 | |
4rxp | DTP | Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 | 3.1.5 | 0.441 | |
1p91 | SAM | 23S rRNA (guanine(745)-N(1))-methyltransferase | / | 0.440 | |
2e8u | IPE | Geranylgeranyl pyrophosphate synthase | / | 0.440 | |
3myt | EQU | Steroid Delta-isomerase | 5.3.3.1 | 0.440 |