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 |
|---|---|---|---|
| 4nu5 | NAD | Phosphonate dehydrogenase | 1.20.1.1 |
| PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
|---|---|---|---|---|---|
| 4nu5 | NAD | Phosphonate dehydrogenase | 1.20.1.1 | 1.000 | |
| 4nu6 | NAD | Phosphonate dehydrogenase | 1.20.1.1 | 0.615 | |
| 4e5m | NAP | Phosphonate dehydrogenase | 1.20.1.1 | 0.591 | |
| 4e5n | NAD | Phosphonate dehydrogenase | 1.20.1.1 | 0.579 | |
| 4e5k | NAD | Phosphonate dehydrogenase | 1.20.1.1 | 0.557 | |
| 2dbz | NAP | Glyoxylate reductase | 1.1.1.26 | 0.525 | |
| 2w2l | NAD | D-mandelate dehydrogenase | / | 0.515 | |
| 1g4t | FTP | Thiamine-phosphate synthase | / | 0.510 | |
| 2tps | TPS | Thiamine-phosphate synthase | / | 0.509 | |
| 1hdc | CBO | 3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase | 1.1.1.53 | 0.495 | |
| 2dbq | NAP | Glyoxylate reductase | 1.1.1.26 | 0.488 | |
| 5hwq | CAA | Hydroxymethylglutaryl-CoA synthase | / | 0.482 | |
| 2ekl | NAD | D-3-phosphoglycerate dehydrogenase | / | 0.477 | |
| 2g5c | NAD | Prephenate dehydrogenase | / | 0.477 | |
| 4z0p | NDP | NAD-dependent dehydrogenase | / | 0.475 | |
| 3sz0 | FAD | Sulfide-quinone reductase | / | 0.472 | |
| 4fc7 | NAP | Peroxisomal 2,4-dienoyl-CoA reductase | 1.3.1.34 | 0.472 | |
| 2hu2 | NAD | C-terminal binding protein 1 | / | 0.469 | |
| 1g67 | TZP | Thiamine-phosphate synthase | / | 0.468 | |
| 2g76 | NAD | D-3-phosphoglycerate dehydrogenase | 1.1.1.95 | 0.467 | |
| 2jn3 | JN3 | Fatty acid-binding protein, liver | / | 0.467 | |
| 3bhi | NAP | Carbonyl reductase [NADPH] 1 | 1.1.1.184 | 0.467 | |
| 3kpk | FAD | Sulfide-quinone reductase | / | 0.467 | |
| 2y1o | T26 | UDP-N-acetylmuramoylalanine--D-glutamate ligase | 6.3.2.9 | 0.466 | |
| 3em0 | CHD | Fatty acid-binding protein 6, ileal (gastrotropin) | / | 0.465 | |
| 3lpi | Z74 | Beta-secretase 1 | 3.4.23.46 | 0.465 | |
| 4mih | FAD | Pyranose 2-oxidase | 1.1.3.10 | 0.465 | |
| 3uko | NAD | Alcohol dehydrogenase class-3 | / | 0.463 | |
| 4xcv | NDP | Probable hydroxyacid dehydrogenase protein | / | 0.463 | |
| 3baz | NAP | Hydroxyphenylpyruvate reductase | 1.1.1.237 | 0.462 | |
| 1g4s | TPS | Thiamine-phosphate synthase | / | 0.461 | |
| 3t14 | FAD | Sulfide-quinone reductase | / | 0.461 | |
| 2q4b | NAP | Uncharacterized protein At5g02240 | / | 0.460 | |
| 3t2z | FAD | Sulfide-quinone reductase | / | 0.460 | |
| 4weq | NAP | NAD-dependent dehydrogenase | / | 0.460 | |
| 1hku | NAD | C-terminal-binding protein 1 | 1.1.1 | 0.459 | |
| 2y05 | NAP | Prostaglandin reductase 1 | / | 0.458 | |
| 5kjc | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.458 | |
| 2znn | S44 | Peroxisome proliferator-activated receptor alpha | / | 0.457 | |
| 5a3b | APR | SIR2 family protein | / | 0.457 | |
| 5kje | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.457 | |
| 3jyn | NDP | Quinone oxidoreductase | / | 0.456 | |
| 4q72 | FAD | Bifunctional protein PutA | / | 0.456 | |
| 5dbg | NAD | Iridoid synthase | 1.3.1.99 | 0.456 | |
| 3t2k | FAD | Sulfide-quinone reductase | / | 0.455 | |
| 2dte | NAI | Glucose 1-dehydrogenase related protein | / | 0.454 | |
| 2hcd | BIV | Vitamin D3 receptor A | / | 0.454 | |
| 3ggo | NAI | Prephenate dehydrogenase | / | 0.454 | |
| 4dpl | NAP | Malonyl-CoA reductase | 1.2.1.75 | 0.454 | |
| 5j23 | A2R | Putative 2-hydroxyacid dehydrogenase | / | 0.454 | |
| 1siq | FAD | Glutaryl-CoA dehydrogenase, mitochondrial | 1.3.8.6 | 0.453 | |
| 3clb | NAP | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.453 | |
| 4bcr | WY1 | Peroxisome proliferator-activated receptor alpha | / | 0.453 | |
| 2cmj | NAP | Isocitrate dehydrogenase [NADP] cytoplasmic | 1.1.1.42 | 0.452 | |
| 3oq6 | NAJ | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.452 | |
| 4is3 | NAD | 3alpha-hydroxy bile acid-CoA-ester 3-dehydrogenase 2 | 1.17.98.1 | 0.452 | |
| 4xd2 | NAI | Alcohol dehydrogenase E chain | 1.1.1.1 | 0.452 | |
| 1ipe | NDP | Tropinone reductase 2 | 1.1.1.236 | 0.451 | |
| 2giv | ACO | Histone acetyltransferase KAT8 | / | 0.451 | |
| 4z3d | NDP | Carbonyl reductase [NADPH] 1 | 1.1.1.184 | 0.451 | |
| 1g69 | TZP | Thiamine-phosphate synthase | / | 0.450 | |
| 3i59 | N6S | CRP-like cAMP-activated global transcriptional regulator | / | 0.450 | |
| 3ruh | NAD | UDP-N-acetylglucosamine 4-epimerase | / | 0.450 | |
| 4jlj | 1NM | Deoxycytidine kinase | 2.7.1.74 | 0.450 | |
| 5jla | NAD | Putative short-chain dehydrogenase/reductase | / | 0.450 | |
| 1x7g | NAP | Putative ketoacyl reductase | 1.3.1 | 0.449 | |
| 1yb5 | NAP | Quinone oxidoreductase | 1.6.5.5 | 0.449 | |
| 2rbe | NDP | Corticosteroid 11-beta-dehydrogenase isozyme 1 | 1.1.1.146 | 0.449 | |
| 2zb3 | NDP | Prostaglandin reductase 2 | 1.3.1.48 | 0.449 | |
| 3ixj | 586 | Beta-secretase 1 | 3.4.23.46 | 0.449 | |
| 3kb6 | NAD | D-lactate dehydrogenase | / | 0.449 | |
| 3gw9 | VNI | Lanosterol 14-alpha-demethylase | / | 0.448 | |
| 4qe6 | JN3 | Bile acid receptor | / | 0.448 | |
| 4zju | NAD | Enoyl-[acyl-carrier-protein] reductase [NADH] | / | 0.448 | |
| 2gcg | NDP | Glyoxylate reductase/hydroxypyruvate reductase | 1.1.1.79 | 0.447 | |
| 2vbd | V10 | Isopenicillin N synthase | 1.21.3.1 | 0.447 | |
| 4xqc | NAD | Homospermidine synthase | 2.5.1.44 | 0.447 | |
| 5a3c | NAD | SIR2 family protein | / | 0.447 | |
| 1h69 | FAD | NAD(P)H dehydrogenase [quinone] 1 | 1.6.5.2 | 0.446 | |
| 2i4j | DRJ | Peroxisome proliferator-activated receptor gamma | / | 0.446 | |
| 3ama | SKE | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.446 | |
| 3hz5 | Z64 | Heat shock protein HSP 90-alpha | / | 0.446 | |
| 3oqk | S52 | Renin | 3.4.23.15 | 0.446 | |
| 3tea | 4CO | 4-hydroxybenzoyl-CoA thioesterase | 3.1.2.23 | 0.446 | |
| 1me6 | IVS | Plasmepsin-2 | 3.4.23.39 | 0.445 | |
| 2npa | MMB | Peroxisome proliferator-activated receptor alpha | / | 0.445 | |
| 4c7k | NAP | Corticosteroid 11-beta-dehydrogenase isozyme 1 | 1.1.1.146 | 0.445 | |
| 1mjb | ACO | Histone acetyltransferase ESA1 | / | 0.444 | |
| 1pr9 | NAP | L-xylulose reductase | 1.1.1.10 | 0.444 | |
| 2cf6 | NAP | Cinnamyl alcohol dehydrogenase 5 | 1.1.1.195 | 0.444 | |
| 2i3g | NAP | N-acetyl-gamma-glutamyl-phosphate reductase | 1.2.1.38 | 0.444 | |
| 3gyu | DL7 | Nuclear hormone receptor of the steroid/thyroid hormone receptors superfamily | / | 0.444 | |
| 3hbb | NAP | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.444 | |
| 3kjr | NAP | Bifunctional dihydrofolate reductase-thymidylate synthase | / | 0.444 | |
| 3kjs | NAP | Bifunctional dihydrofolate reductase-thymidylate synthase | / | 0.444 | |
| 3oib | FDA | Putative acyl-CoA dehydrogenase | / | 0.444 | |
| 4gdy | 0X1 | Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial | 2.6.1.39 | 0.444 | |
| 4z44 | FAD | Flavin-dependent tryptophan halogenase PrnA | 1.14.19.9 | 0.444 | |
| 1guf | NDP | Enoyl-[acyl-carrier-protein] reductase 1, mitochondrial | 1.3.1.10 | 0.443 | |
| 1osv | CHC | Bile acid receptor | / | 0.443 | |
| 2gjl | FMN | Nitronate monooxygenase | 1.13.12.16 | 0.443 | |
| 2jah | NDP | Clavaldehyde dehydrogenase | / | 0.443 | |
| 3bg7 | FAD | Pyranose 2-oxidase | / | 0.443 | |
| 3mpj | FAD | Glutaryl-CoA dehydrogenase | 1.3.99.32 | 0.443 | |
| 3sp6 | IL2 | Peroxisome proliferator-activated receptor alpha | / | 0.443 | |
| 4rpj | FAD | UDP-galactopyranose mutase | 5.4.99.9 | 0.443 | |
| 4xq9 | NAD | Homospermidine synthase | 2.5.1.44 | 0.443 | |
| 5bqf | NAP | Probable hydroxyacid dehydrogenase protein | / | 0.443 | |
| 1e6w | NAD | 3-hydroxyacyl-CoA dehydrogenase type-2 | 1.1.1.35 | 0.442 | |
| 1ppj | ANY | Cytochrome b | / | 0.442 | |
| 3iah | NAP | Putative oxoacyl-(Acyl carrier protein) reductase | / | 0.442 | |
| 4dpw | AGS | Mevalonate diphosphate decarboxylase | / | 0.442 | |
| 4fd2 | ADP | Chaperone protein ClpB | / | 0.442 | |
| 4wda | 2AM | 2',3'-cyclic-nucleotide 3'-phosphodiesterase | 3.1.4.37 | 0.442 | |
| 5jsc | FAD | Putative acyl-CoA dehydrogenase | / | 0.442 | |
| 1h2b | NAJ | NAD-dependent alcohol dehydrogenase | / | 0.441 | |
| 1qor | NDP | Quinone oxidoreductase 1 | / | 0.441 | |
| 2fzw | NAD | Alcohol dehydrogenase class-3 | 1.1.1.1 | 0.441 | |
| 2qa2 | FAD | Polyketide oxygenase CabE | / | 0.441 | |
| 2qd4 | CHD | Ferrochelatase, mitochondrial | 4.99.1.1 | 0.441 | |
| 3cty | FAD | Probable thioredoxin reductase | / | 0.441 | |
| 3syi | FAD | Sulfide-quinone reductase | / | 0.441 | |
| 4ge4 | 0KE | Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial | 2.6.1.39 | 0.441 | |
| 4l4x | NDP | AmphI | / | 0.441 | |
| 4nmd | FDA | Bifunctional protein PutA | / | 0.441 | |
| 4rvu | NDP | Probable quinone reductase Qor (NADPH:quinone reductase) (Zeta-crystallin homolog protein) | / | 0.441 | |
| 1hb3 | SCV | Isopenicillin N synthase | 1.21.3.1 | 0.440 | |
| 1xq6 | NAP | Uncharacterized protein At5g02240 | / | 0.440 | |
| 2cdu | FAD | NADH oxidase | / | 0.440 | |
| 2ft9 | CHD | Fatty acid-binding protein 2, liver | / | 0.440 | |
| 3ohf | 3HF | Beta-secretase 1 | 3.4.23.46 | 0.440 | |
| 3uyl | TYD | Probable NDP-rhamnosyltransferase | / | 0.440 | |
| 4b8w | NAP | GDP-L-fucose synthase | 1.1.1.271 | 0.440 | |
| 4l8u | 9AZ | Serum albumin | / | 0.440 | |
| 4ly9 | 1YY | Glucokinase regulatory protein | / | 0.440 | |
| 4q73 | FAD | Bifunctional protein PutA | / | 0.440 |