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 |
---|---|---|---|
4ywj | NAD | 4-hydroxy-tetrahydrodipicolinate reductase |
PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
---|---|---|---|---|---|
4ywj | NAD | 4-hydroxy-tetrahydrodipicolinate reductase | / | 1.000 | |
5ees | NAP | 4-hydroxy-tetrahydrodipicolinate reductase | / | 0.579 | |
2zs9 | ADP | Pantothenate kinase | 2.7.1.33 | 0.511 | |
1yl7 | NAI | 4-hydroxy-tetrahydrodipicolinate reductase | / | 0.508 | |
4f5d | C2E | Stimulator of interferon genes protein | / | 0.508 | |
1vfr | FMN | Major NAD(P)H-flavin oxidoreductase | 1.6.99 | 0.500 | |
4qak | 2AM | RNA 2',3'-cyclic phosphodiesterase | / | 0.489 | |
3gg2 | UGA | Sugar dehydrogenase, UDP-glucose/GDP-mannose dehydrogenase family | / | 0.485 | |
4ifn | 12O | Kelch-like ECH-associated protein 1 | / | 0.480 | |
2r2n | KYN | Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial | 2.6.1.39 | 0.479 | |
4jdc | NAD | Probable pyrroline-5-carboxylate dehydrogenase RocA | / | 0.476 | |
3af0 | GDP | Pantothenate kinase | 2.7.1.33 | 0.475 | |
4d6q | PD2 | Lysine-specific demethylase 4D | 1.14.11 | 0.474 | |
1kqb | FMN | Oxygen-insensitive NAD(P)H nitroreductase | / | 0.473 | |
3nlz | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.473 | |
1h6c | NDP | Glucose--fructose oxidoreductase | 1.1.99.28 | 0.470 | |
1n0s | FLU | Bilin-binding protein | / | 0.470 | |
3af1 | GDP | Pantothenate kinase | 2.7.1.33 | 0.470 | |
4g0k | 0VS | Glutathionyl-hydroquinone reductase YqjG | 1.8 | 0.470 | |
1f9a | ATP | Nicotinamide-nucleotide adenylyltransferase | / | 0.469 | |
2cul | FAD | GidA-related protein | / | 0.468 | |
2ges | COK | Pantothenate kinase | 2.7.1.33 | 0.468 | |
2geu | COK | Pantothenate kinase | 2.7.1.33 | 0.467 | |
3qiy | QI1 | Botulinum neurotoxin type A | 3.4.24.69 | 0.467 | |
1h6b | NDP | Glucose--fructose oxidoreductase | 1.1.99.28 | 0.466 | |
2h63 | NAP | Biliverdin reductase A | 1.3.1.24 | 0.466 | |
2hay | FMN | Putative NAD(P)H-flavin oxidoreductase | / | 0.466 | |
1sir | NBC | Glutaryl-CoA dehydrogenase, mitochondrial | 1.3.8.6 | 0.465 | |
4fa3 | 0SL | Aldo-keto reductase family 1 member C3 | / | 0.465 | |
1oo5 | FMN | Oxygen-insensitive NAD(P)H nitroreductase | / | 0.464 | |
3zky | WT4 | Isopenicillin N synthase | 1.21.3.1 | 0.464 | |
4loh | 1SY | Stimulator of interferon genes protein | / | 0.464 | |
4imt | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.463 | |
3hf3 | FMN | Chromate reductase | / | 0.462 | |
4eux | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.462 | |
4yp1 | 2BA | Stimulator of interferon genes protein | / | 0.461 | |
1hb1 | OCV | Isopenicillin N synthase | 1.21.3.1 | 0.460 | |
1m9n | AMZ | Bifunctional purine biosynthesis protein PURH | 2.1.2.3 | 0.460 | |
1ses | AHX | Serine--tRNA ligase | 6.1.1.11 | 0.460 | |
1zzu | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.460 | |
3rqj | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.460 | |
1hb3 | SCV | Isopenicillin N synthase | 1.21.3.1 | 0.459 | |
2hx4 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.459 | |
3b3n | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.459 | |
3frc | 0HG | Glutathione S-transferase | 2.5.1.18 | 0.459 | |
5cfl | C2E | Stimulator of interferon genes protein | / | 0.459 | |
3pzc | COA | Amino acid--[acyl-carrier-protein] ligase 1 | 6.2.1.n2 | 0.458 | |
1k4m | NAD | Nicotinate-nucleotide adenylyltransferase | 2.7.7.18 | 0.457 | |
2oo5 | TXD | NAD(P) transhydrogenase subunit alpha part 1 | 1.6.1.2 | 0.457 | |
3jxe | TYM | Tryptophan--tRNA ligase | / | 0.457 | |
3tdk | UPG | UDP-glucose 6-dehydrogenase | 1.1.1.22 | 0.457 | |
1nj5 | P5A | Proline--tRNA ligase | / | 0.456 | |
2p9c | NAI | D-3-phosphoglycerate dehydrogenase | 1.1.1.95 | 0.456 | |
3m2t | NAD | Probable dehydrogenase | / | 0.456 | |
1n4q | LYS_CYS_VAL_ILE_LEU | Geranylgeranyl transferase type-1 subunit beta | 2.5.1.59 | 0.455 | |
2hq9 | FAD | Mll6688 protein | / | 0.455 | |
2r2l | PB9 | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.455 | |
3jt4 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.455 | |
3nln | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.455 | |
4k36 | SAM | Anaerobic sulfatase-maturating enzyme | 1.8.98 | 0.455 | |
4qbi | AP5 | Adenylate kinase | / | 0.455 | |
1h6d | NDP | Glucose--fructose oxidoreductase | 1.1.99.28 | 0.454 | |
3e32 | ED2 | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.454 | |
3jq3 | ADP | Lombricine kinase | / | 0.454 | |
4fvy | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.454 | |
2obx | INI | 6,7-dimethyl-8-ribityllumazine synthase 2 | 2.5.1.78 | 0.453 | |
3x21 | FMN | Oxygen-insensitive NAD(P)H nitroreductase | / | 0.453 | |
4in4 | 4ID | Kelch-like ECH-associated protein 1 | / | 0.453 | |
1ikg | REX | D-alanyl-D-alanine carboxypeptidase | 3.4.16.4 | 0.452 | |
1re0 | AFB | ADP-ribosylation factor 1 | / | 0.452 | |
1re0 | AFB | ARF guanine-nucleotide exchange factor 1 | / | 0.452 | |
3ntr | NAD | Inositol 2-dehydrogenase/D-chiro-inositol 3-dehydrogenase | 1.1.1.18 | 0.452 | |
3pnf | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.452 | |
4r20 | AER | Cytochrome P450 family 17 polypeptide 2 | / | 0.452 | |
1evj | NAD | Glucose--fructose oxidoreductase | 1.1.99.28 | 0.451 | |
1g2v | TTP | Glucose-1-phosphate thymidylyltransferase | / | 0.451 | |
3n61 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.451 | |
3x0c | 5GP | Phosphatidylinositol 5-phosphate 4-kinase type-2 beta | 2.7.1.149 | 0.451 | |
2zsa | ADP | Pantothenate kinase | 2.7.1.33 | 0.450 | |
3ge6 | FMN | Nitroreductase | / | 0.450 | |
3jwv | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.450 | |
3mp3 | HGG | Hydroxymethylglutaryl-CoA lyase, mitochondrial | 4.1.3.4 | 0.450 | |
4cx3 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.450 | |
4i1c | 1BE | Beta-secretase 1 | 3.4.23.46 | 0.450 | |
4lb9 | EVP | Serum albumin | / | 0.450 | |
1jk3 | BAT | Macrophage metalloelastase | 3.4.24.65 | 0.449 | |
3ojo | PDC | Cap5O | / | 0.449 | |
4f5y | C2E | Stimulator of interferon genes protein | / | 0.449 | |
5a65 | TPP | Thiamine-triphosphatase | 3.6.1.28 | 0.449 | |
1dgb | NDP | Catalase | 1.11.1.6 | 0.448 | |
2jb4 | A14 | Isopenicillin N synthase | 1.21.3.1 | 0.448 | |
2zs8 | ADP | Pantothenate kinase | 2.7.1.33 | 0.448 | |
1icv | FMN | Oxygen-insensitive NAD(P)H nitroreductase | / | 0.447 | |
1oon | FMN | Oxygen-insensitive NAD(P)H nitroreductase | / | 0.447 | |
2vbp | VB1 | Isopenicillin N synthase | 1.21.3.1 | 0.447 | |
3k5f | AYH | Beta-secretase 1 | 3.4.23.46 | 0.447 | |
3od4 | 8XQ | Hypoxia-inducible factor 1-alpha inhibitor | 1.14.11.30 | 0.447 | |
3rqk | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.447 | |
4fvz | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.447 | |
1zw9 | H64 | ATP-dependent molecular chaperone HSP82 | / | 0.446 | |
2fm5 | M99 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.446 | |
2get | COK | Pantothenate kinase | 2.7.1.33 | 0.446 | |
2jnp | NGH | Stromelysin-1 | 3.4.24.17 | 0.446 | |
3nlw | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.446 | |
3zoi | M2W | Isopenicillin N synthase | 1.21.3.1 | 0.446 | |
4fvx | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.446 | |
4fw0 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.446 | |
4j7h | TRH | PCZA361.3 | / | 0.446 | |
2fhl | BNI | Avidin-related protein 4/5 | / | 0.445 | |
2vbd | V10 | Isopenicillin N synthase | 1.21.3.1 | 0.445 | |
2vpr | TDC | Tetracycline repressor protein class H | / | 0.445 | |
2x86 | ADP | ADP-L-glycero-D-manno-heptose-6-epimerase | / | 0.445 | |
3tlc | 7MD | Microcin C7 self-immunity protein MccF | / | 0.445 | |
3ufw | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.445 | |
3zg6 | APR | NAD-dependent protein deacetylase sirtuin-6 | 3.5.1 | 0.445 | |
4ise | 1FW | Glucokinase | 2.7.1.2 | 0.445 | |
1w0k | ADP | ATP synthase subunit alpha, mitochondrial | / | 0.444 | |
1w0k | ADP | ATP synthase subunit beta, mitochondrial | 3.6.3.14 | 0.444 | |
1yci | NDF | Hypoxia-inducible factor 1-alpha inhibitor | 1.14.11.30 | 0.444 | |
3gcq | 1BU | Mitogen-activated protein kinase 14 | / | 0.444 | |
3ptz | UDX | UDP-glucose 6-dehydrogenase | 1.1.1.22 | 0.444 | |
5a02 | NAP | Glucose-fructose oxidoreductase | / | 0.444 | |
5a03 | NDP | Glucose-fructose oxidoreductase | / | 0.444 | |
1ofg | NDP | Glucose--fructose oxidoreductase | 1.1.99.28 | 0.443 | |
1qiq | ACC | Isopenicillin N synthase | 1.21.3.1 | 0.443 | |
1s64 | 778 | Geranylgeranyl transferase type-1 subunit beta | 2.5.1.59 | 0.443 | |
1tll | FMN | Nitric oxide synthase, brain | 1.14.13.39 | 0.443 | |
2xei | ARK | Glutamate carboxypeptidase 2 | 3.4.17.21 | 0.443 | |
2y6f | M9F | Isopenicillin N synthase | 1.21.3.1 | 0.443 | |
3c3x | NAP | Eugenol synthase 1 | 1.1.1.318 | 0.443 | |
3ghh | 2NF | CD38 molecule | / | 0.443 | |
4mv8 | ACP | Biotin carboxylase | 6.3.4.14 | 0.443 | |
2a0x | DIH | Purine nucleoside phosphorylase | 2.4.2.1 | 0.442 | |
2y1t | DUD | SPBc2 prophage-derived deoxyuridine 5'-triphosphate nucleotidohydrolase YosS | 3.6.1.23 | 0.442 | |
3abx | RCB | Glucanase | / | 0.442 | |
3aez | GDP | Pantothenate kinase | 2.7.1.33 | 0.442 | |
3hdq | GDU | UDP-galactopyranose mutase | / | 0.442 | |
3tle | GSU | Microcin C7 self-immunity protein MccF | / | 0.442 | |
3ufq | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.442 | |
1mmv | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.441 | |
1rs6 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.441 | |
2hiz | LIJ | Beta-secretase 1 | 3.4.23.46 | 0.441 | |
3clu | FAD | Electron transfer flavoprotein subunit alpha | / | 0.441 | |
3dha | C6L | N-acyl homoserine lactonase AiiA | 3.1.1.81 | 0.441 | |
3jt8 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.441 | |
3jta | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.441 | |
3mz9 | BHN | Nickel-binding periplasmic protein | / | 0.441 | |
3nt2 | NAD | Inositol 2-dehydrogenase/D-chiro-inositol 3-dehydrogenase | 1.1.1.18 | 0.441 | |
3uft | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.441 | |
4iix | 1EG | Microcin C7 self-immunity protein MccF | / | 0.441 | |
4l1f | COS | Acyl-CoA dehydrogenase domain protein | / | 0.441 | |
5bv3 | M7G | m7GpppX diphosphatase | 3.6.1.59 | 0.441 | |
5ig2 | NAD | Short-chain dehydrogenase/reductase SDR | / | 0.441 | |
1k2u | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.440 | |
2pa3 | NAI | D-3-phosphoglycerate dehydrogenase | 1.1.1.95 | 0.440 | |
2z9d | FMN | FMN-dependent NADH-azoreductase | / | 0.440 | |
2zse | ACP | Pantothenate kinase | 2.7.1.33 | 0.440 | |
3fr5 | I4A | Fatty acid-binding protein, adipocyte | / | 0.440 | |
3pfh | T3Q | dTDP-3-amino-3,6-dideoxy-alpha-D-glucopyranose N,N-dimethyltransferase | 2.1.1.235 | 0.440 | |
4jsg | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.440 |