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 |
---|---|---|---|
3rj5 | NAD | Alcohol dehydrogenase | 1.1.1.1 |
PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
---|---|---|---|---|---|
3rj5 | NAD | Alcohol dehydrogenase | 1.1.1.1 | 1.000 | |
1b15 | NAE | Alcohol dehydrogenase | 1.1.1.1 | 0.663 | |
1b14 | NAD | Alcohol dehydrogenase | 1.1.1.1 | 0.631 | |
1b16 | NAQ | Alcohol dehydrogenase | 1.1.1.1 | 0.631 | |
3rj9 | NAD | Alcohol dehydrogenase | 1.1.1.1 | 0.626 | |
1mg5 | NAI | Alcohol dehydrogenase | 1.1.1.1 | 0.584 | |
1sby | NAD | Alcohol dehydrogenase | 1.1.1.1 | 0.581 | |
2dkn | NAI | 3-alpha-hydroxysteroid dehydrogenase | / | 0.534 | |
5lc1 | NAD | L-threonine 3-dehydrogenase | / | 0.531 | |
5jla | NAD | Putative short-chain dehydrogenase/reductase | / | 0.527 | |
3uxy | NAD | Short-chain dehydrogenase/reductase SDR | / | 0.525 | |
3a4v | NAD | NDP-sugar epimerase | / | 0.524 | |
4gh5 | NAD | Short-chain dehydrogenase/reductase SDR | / | 0.523 | |
1u7t | TDT | 3-hydroxyacyl-CoA dehydrogenase type-2 | 1.1.1.35 | 0.522 | |
3ndr | NAD | Pyridoxal 4-dehydrogenase | 1.1.1.107 | 0.519 | |
4nbu | NAI | 3-oxoacyl-(Acyl-carrier-protein) reductase | / | 0.519 | |
1e3w | NAD | 3-hydroxyacyl-CoA dehydrogenase type-2 | 1.1.1.35 | 0.518 | |
3wds | NAD | NADH-dependent quinuclidinone reductase | / | 0.512 | |
1iy8 | NAD | Levodione reductase | / | 0.511 | |
3ak4 | NAD | NADH-dependent quinuclidinone reductase | / | 0.508 | |
4fw8 | NAI | 3-oxoacyl-(Acyl-carrier-protein) reductase | / | 0.508 | |
1pr9 | NAP | L-xylulose reductase | 1.1.1.10 | 0.506 | |
2wsb | NAD | Galactitol dehydrogenase | / | 0.504 | |
1cyd | NDP | Carbonyl reductase [NADPH] 2 | 1.1.1.184 | 0.501 | |
1e6w | NAD | 3-hydroxyacyl-CoA dehydrogenase type-2 | 1.1.1.35 | 0.500 | |
1nfr | NAD | 3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase | 1.1.1.53 | 0.500 | |
1zem | NAD | Xylitol dehydrogenase | / | 0.497 | |
1edo | NAP | 3-oxoacyl-[acyl-carrier-protein] reductase 1, chloroplastic | 1.1.1.100 | 0.496 | |
1geg | NAD | Diacetyl reductase [(S)-acetoin forming] | 1.1.1.304 | 0.496 | |
2ewm | NAD | (S)-1-Phenylethanol dehydrogenase | 1.1.1.311 | 0.496 | |
3a28 | NAD | L-2,3-butanediol dehydrogenase | 1.1.1.76 | 0.495 | |
1nff | NAD | 3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase | 1.1.1.53 | 0.493 | |
4is3 | NAD | 3alpha-hydroxy bile acid-CoA-ester 3-dehydrogenase 2 | 1.17.98.1 | 0.492 | |
5jsf | NAD | 17-beta-hydroxysteroid dehydrogenase 14 | 1.1.1 | 0.491 | |
1xg5 | NAP | Dehydrogenase/reductase SDR family member 11 | / | 0.490 | |
2dte | NAI | Glucose 1-dehydrogenase related protein | / | 0.490 | |
1e3s | NAD | 3-hydroxyacyl-CoA dehydrogenase type-2 | 1.1.1.35 | 0.485 | |
3gy0 | NAP | NAD(P)-dependent oxidoreductase | / | 0.484 | |
3a1n | NAD | NDP-sugar epimerase | / | 0.483 | |
3tox | NAP | Putative oxidoreductase | / | 0.482 | |
1wnt | NAP | L-xylulose reductase | 1.1.1.10 | 0.481 | |
1g0n | NDP | Tetrahydroxynaphthalene reductase | 1.1.1.252 | 0.480 | |
2yut | NAP | Putative short-chain oxidoreductase | / | 0.480 | |
2wdz | NAD | Galactitol dehydrogenase | / | 0.479 | |
3qrw | NDP | Putative ketoacyl reductase | 1.3.1 | 0.479 | |
4dc1 | NDP | Putative ketoacyl reductase | 1.3.1 | 0.479 | |
4qec | NAP | ElxO | / | 0.479 | |
1w4z | NAP | Putative ketoacyl reductase | 1.3.1 | 0.478 | |
4rf2 | NAP | NADPH dependent R-specific alcohol dehydrogenase | / | 0.478 | |
2yy7 | NAD | L-threonine dehydrogenase | / | 0.477 | |
3qwf | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.477 | |
2ztm | NAD | D(-)-3-hydroxybutyrate dehydrogenase | / | 0.476 | |
3nug | NAD | Pyridoxal 4-dehydrogenase | 1.1.1.107 | 0.476 | |
1xkq | NDP | Uncharacterized protein | / | 0.475 | |
3w8e | NAD | 3-hydroxybutyrate dehydrogenase | / | 0.475 | |
4wlv | NAD | Malate dehydrogenase, mitochondrial | 1.1.1.37 | 0.475 | |
3bhi | NAP | Carbonyl reductase [NADPH] 1 | 1.1.1.184 | 0.473 | |
3w8f | NAD | 3-hydroxybutyrate dehydrogenase | / | 0.472 | |
4bmv | NAP | Short-chain dehydrogenase | / | 0.472 | |
3d3w | NAP | L-xylulose reductase | 1.1.1.10 | 0.471 | |
4i5e | NAP | Alclohol dehydrogenase/short-chain dehydrogenase | / | 0.471 | |
2ag5 | NAD | 3-hydroxybutyrate dehydrogenase type 2 | / | 0.470 | |
4lis | NAD | UDP-glucose 4-epimerase (Eurofung) | / | 0.470 | |
4pvd | NDP | NADPH-dependent methylglyoxal reductase GRE2 | / | 0.469 | |
4z3d | NDP | Carbonyl reductase [NADPH] 1 | 1.1.1.184 | 0.469 | |
5js6 | NAD | 17-beta-hydroxysteroid dehydrogenase 14 | 1.1.1 | 0.469 | |
1ae1 | NAP | Tropinone reductase 1 | / | 0.468 | |
2q2q | NAD | Beta-D-hydroxybutyrate dehydrogenase | / | 0.468 | |
4nbt | NAD | 3-oxoacyl-[acyl-carrier-protein] reductase | / | 0.467 | |
4c7k | NAP | Corticosteroid 11-beta-dehydrogenase isozyme 1 | 1.1.1.146 | 0.466 | |
4cql | NAD | Estradiol 17-beta-dehydrogenase 8 | 1.1.1.62 | 0.466 | |
1sny | NAP | LD36273p | / | 0.465 | |
3sju | NDP | Keto reductase | / | 0.464 | |
3sx2 | NAD | Uncharacterized protein | / | 0.464 | |
1x7h | NDP | Putative ketoacyl reductase | 1.3.1 | 0.463 | |
4j7u | NAP | Sepiapterin reductase | 1.1.1.153 | 0.463 | |
2c54 | NAD | GDP-mannose 3,5-epimerase | 5.1.3.18 | 0.462 | |
2gdz | NAD | 15-hydroxyprostaglandin dehydrogenase [NAD(+)] | 1.1.1.141 | 0.462 | |
4wlu | NAD | Malate dehydrogenase, mitochondrial | 1.1.1.37 | 0.461 | |
1ipe | NDP | Tropinone reductase 2 | 1.1.1.236 | 0.460 | |
3iah | NAP | Putative oxoacyl-(Acyl carrier protein) reductase | / | 0.460 | |
2d1y | NAD | Oxidoreductase, short-chain dehydrogenase/reductase family | / | 0.459 | |
2p5u | NAD | UDP-glucose 4-epimerase | / | 0.459 | |
4fj2 | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.459 | |
3ai2 | NDP | NADPH-sorbose reductase | / | 0.457 | |
3o4r | NAP | Dehydrogenase/reductase SDR family member 4 | 1.1.1.184 | 0.457 | |
3s55 | NAD | Putative short-chain dehydrogenase/reductase | / | 0.457 | |
4fj1 | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.456 | |
4imp | NDP | Polyketide synthase extender modules 3-4 | / | 0.456 | |
4iqg | NAP | Short-chain dehydrogenase/reductase SDR | / | 0.456 | |
3hja | NAD | Glyceraldehyde-3-phosphate dehydrogenase | / | 0.455 | |
1vl8 | NAP | Oxidoreductase, short chain dehydrogenase/reductase family | / | 0.454 | |
3ggo | NAI | Prephenate dehydrogenase | / | 0.454 | |
1g1a | NAD | dTDP-glucose 4,6-dehydratase | / | 0.453 | |
3w8d | NAD | 3-hydroxybutyrate dehydrogenase | / | 0.453 | |
3ajr | NAD | NDP-sugar epimerase | / | 0.451 | |
3uce | NDP | Dehydrogenase | / | 0.451 | |
4fj0 | NAP | 17beta-hydroxysteroid dehydrogenase | / | 0.450 | |
5idw | NAP | Short-chain dehydrogenase/reductase SDR | / | 0.450 | |
4j7x | NAP | Sepiapterin reductase | 1.1.1.153 | 0.449 | |
1z7e | ATP | Bifunctional polymyxin resistance protein ArnA | / | 0.448 | |
3lqf | NAD | Galactitol dehydrogenase | / | 0.448 | |
1n5d | NDP | Carbonyl reductase [NADPH] 1 | / | 0.447 | |
4fn4 | NAD | Short chain dehydrogenase | / | 0.447 | |
4qed | NAP | ElxO | / | 0.447 | |
4yai | NAI | C alpha-dehydrogenase | / | 0.447 | |
4yr9 | NAD | L-threonine 3-dehydrogenase, mitochondrial | 1.1.1.103 | 0.447 | |
2q2v | NAD | Beta-D-hydroxybutyrate dehydrogenase | / | 0.444 | |
4ajp | 88N | L-lactate dehydrogenase A chain | 1.1.1.27 | 0.443 | |
4nbw | NAD | Short-chain dehydrogenase/reductase SDR | / | 0.443 | |
3g49 | NAP | Corticosteroid 11-beta-dehydrogenase isozyme 1 | 1.1.1.146 | 0.442 | |
1h5q | NAP | NADP-dependent mannitol dehydrogenase | 1.1.1.138 | 0.441 | |
4hwk | NAP | Sepiapterin reductase | 1.1.1.153 | 0.441 | |
3pgx | NAD | Uncharacterized NAD-dependent oxidoreductase MAP_4146 | / | 0.440 |