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 |
---|---|---|---|
2f2k | TGG | Aldose reductase | 1.1.1.21 |
PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
---|---|---|---|---|---|
2f2k | TGG | Aldose reductase | 1.1.1.21 | 1.000 | |
3u2c | SUZ | Aldose reductase | 1.1.1.21 | 0.725 | |
2pdy | FID | Aldose reductase | 1.1.1.21 | 0.666 | |
3v35 | NTI | Aldose reductase | 1.1.1.21 | 0.642 | |
3s3g | TLT | Aldose reductase | 1.1.1.21 | 0.614 | |
1ef3 | FID | Aldose reductase | 1.1.1.21 | 0.609 | |
2inz | OHP | Aldose reductase | 1.1.1.21 | 0.607 | |
2pdw | FID | Aldose reductase | 1.1.1.21 | 0.604 | |
2nvc | ITA | Aldose reductase | 1.1.1.21 | 0.599 | |
2pd9 | FID | Aldose reductase | 1.1.1.21 | 0.586 | |
1pwm | FID | Aldose reductase | 1.1.1.21 | 0.584 | |
2pdk | SBI | Aldose reductase | 1.1.1.21 | 0.580 | |
4gab | FID | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.576 | |
3p2v | DOY | Aldose reductase | 1.1.1.21 | 0.575 | |
5liu | 388 | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.568 | |
2agt | FID | Aldose reductase | 1.1.1.21 | 0.566 | |
2is7 | 2CL | Aldose reductase | 1.1.1.21 | 0.566 | |
2pdj | 393 | Aldose reductase | 1.1.1.21 | 0.566 | |
2pdu | 393 | Aldose reductase | 1.1.1.21 | 0.566 | |
1eko | I84 | Aldose reductase | 1.1.1.21 | 0.565 | |
2iqd | LPA | Aldose reductase | 1.1.1.21 | 0.555 | |
2fz8 | ZST | Aldose reductase | 1.1.1.21 | 0.554 | |
1ah0 | SBI | Aldose reductase | 1.1.1.21 | 0.553 | |
2pdf | ZST | Aldose reductase | 1.1.1.21 | 0.552 | |
3ghs | LDT | Aldose reductase | 1.1.1.21 | 0.551 | |
1el3 | I84 | Aldose reductase | 1.1.1.21 | 0.540 | |
4wev | SUZ | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.540 | |
2pdx | ZST | Aldose reductase | 1.1.1.21 | 0.538 | |
3ghr | LDT | Aldose reductase | 1.1.1.21 | 0.537 | |
2iki | 388 | Aldose reductase | 1.1.1.21 | 0.531 | |
2pdp | 393 | Aldose reductase | 1.1.1.21 | 0.530 | |
3ght | LDT | Aldose reductase | 1.1.1.21 | 0.529 | |
4gca | 2X9 | Aldose reductase | 1.1.1.21 | 0.529 | |
2fz9 | ZST | Aldose reductase | 1.1.1.21 | 0.528 | |
1iei | ZES | Aldose reductase | 1.1.1.21 | 0.527 | |
2i17 | LDT | Aldose reductase | 1.1.1.21 | 0.524 | |
2pzn | 393 | Aldose reductase | 1.1.1.21 | 0.520 | |
2dv0 | ZST | Aldose reductase | 1.1.1.21 | 0.516 | |
2hvo | ZST | Aldose reductase | 1.1.1.21 | 0.516 | |
1t40 | ID5 | Aldose reductase | 1.1.1.21 | 0.515 | |
2pdh | 47D | Aldose reductase | 1.1.1.21 | 0.510 | |
4ga8 | SBI | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.510 | |
2hvn | ZST | Aldose reductase | 1.1.1.21 | 0.509 | |
3lbo | LDT | Aldose reductase | 1.1.1.21 | 0.508 | |
3lql | LDT | Aldose reductase | 1.1.1.21 | 0.508 | |
3m4h | 388 | Aldose reductase | 1.1.1.21 | 0.507 | |
2pdg | 47D | Aldose reductase | 1.1.1.21 | 0.506 | |
2hv5 | ZST | Aldose reductase | 1.1.1.21 | 0.505 | |
2pdl | TOL | Aldose reductase | 1.1.1.21 | 0.502 | |
3m64 | 393 | Aldose reductase | 1.1.1.21 | 0.502 | |
2fzd | TOL | Aldose reductase | 1.1.1.21 | 0.501 | |
1z3n | 3NA | Aldose reductase | 1.1.1.21 | 0.500 | |
3mb9 | ZST | Aldose reductase | 1.1.1.21 | 0.500 | |
3ld5 | LDT | Aldose reductase | 1.1.1.21 | 0.498 | |
4yu1 | 53N | Aldose reductase | 1.1.1.21 | 0.498 | |
3lz5 | LDT | Aldose reductase | 1.1.1.21 | 0.497 | |
2i16 | LDT | Aldose reductase | 1.1.1.21 | 0.496 | |
3ghu | LDT | Aldose reductase | 1.1.1.21 | 0.495 | |
1z89 | 62P | Aldose reductase | 1.1.1.21 | 0.494 | |
2cbq | TH2 | Neocarzinostatin | / | 0.494 | |
3len | ZST | Aldose reductase | 1.1.1.21 | 0.494 | |
2ikj | 393 | Aldose reductase | 1.1.1.21 | 0.487 | |
2qxw | LDT | Aldose reductase | 1.1.1.21 | 0.487 | |
1pax | DHQ | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.482 | |
1zgb | A1E | Acetylcholinesterase | 3.1.1.7 | 0.482 | |
2jl1 | NAP | Triphenylmethane reductase | / | 0.480 | |
3nu0 | 3TU | Dihydrofolate reductase | 1.5.1.3 | 0.480 | |
2fzb | TOL | Aldose reductase | 1.1.1.21 | 0.478 | |
3g5e | Q74 | Aldose reductase | 1.1.1.21 | 0.478 | |
1us0 | LDT | Aldose reductase | 1.1.1.21 | 0.477 | |
1u70 | MTX | Dihydrofolate reductase | 1.5.1.3 | 0.475 | |
1frb | ZST | Aldose reductase-related protein 2 | / | 0.474 | |
2vbp | VB1 | Isopenicillin N synthase | 1.21.3.1 | 0.473 | |
3qeo | LLT | Deoxycytidine kinase | 2.7.1.74 | 0.473 | |
2dux | ZST | Aldose reductase | 1.1.1.21 | 0.471 | |
4b11 | 7I1 | Glycylpeptide N-tetradecanoyltransferase | / | 0.471 | |
4bfw | ZVW | Pantothenate kinase | 2.7.1.33 | 0.470 | |
1ry8 | RUT | Aldo-keto reductase family 1 member C3 | / | 0.469 | |
1rxj | BNI | Streptavidin | / | 0.468 | |
3hxc | BD6 | Geranylgeranyl transferase type-2 subunit beta | 2.5.1.60 | 0.468 | |
1kms | LIH | Dihydrofolate reductase | 1.5.1.3 | 0.467 | |
1zq5 | E04 | Aldo-keto reductase family 1 member C3 | / | 0.467 | |
2ipw | 2CL | Aldose reductase | 1.1.1.21 | 0.467 | |
2xup | TZ5 | Acetylcholinesterase | 3.1.1.7 | 0.467 | |
3mc5 | 393 | Aldose reductase | 1.1.1.21 | 0.466 | |
1w76 | GNT | Acetylcholinesterase | 3.1.1.7 | 0.465 | |
3o56 | ZG1 | cAMP-specific 3',5'-cyclic phosphodiesterase 4B | 3.1.4.53 | 0.465 | |
4a31 | 2CB | Glycylpeptide N-tetradecanoyltransferase | / | 0.465 | |
5d6l | CAU | Beta-2 adrenergic receptor | / | 0.465 | |
1hfr | MOT | Dihydrofolate reductase | 1.5.1.3 | 0.464 | |
2ipi | AKY | Aclacinomycin-N/aclacinomycin-A oxidase | / | 0.464 | |
4keb | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.463 | |
4usq | FAD | Pyridine nucleotide-disulfide oxidoreductase | / | 0.462 | |
3u57 | DH8 | Raucaffricine-O-beta-D-glucosidase | 3.2.1.125 | 0.461 | |
1lnm | DTX | Bilin-binding protein | / | 0.460 | |
1q84 | TZ4 | Acetylcholinesterase | 3.1.1.7 | 0.460 | |
2fm5 | M99 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.460 | |
2nmt | MIM | Glycylpeptide N-tetradecanoyltransferase | 2.3.1.97 | 0.460 | |
2vcm | M11 | Isopenicillin N synthase | 1.21.3.1 | 0.460 | |
4b14 | 4XB | Glycylpeptide N-tetradecanoyltransferase | / | 0.460 | |
1ut6 | A8N | Acetylcholinesterase | 3.1.1.7 | 0.459 | |
3g58 | 988 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.459 | |
4b12 | C23 | Glycylpeptide N-tetradecanoyltransferase | / | 0.459 | |
1blz | ACV | Isopenicillin N synthase | 1.21.3.1 | 0.458 | |
1n0s | FLU | Bilin-binding protein | / | 0.458 | |
1t41 | ID5 | Aldose reductase | 1.1.1.21 | 0.458 | |
3qe2 | FMN | NADPH--cytochrome P450 reductase | / | 0.458 | |
1lke | DOG | Bilin-binding protein | / | 0.457 | |
1mvt | DTM | Dihydrofolate reductase | 1.5.1.3 | 0.457 | |
1ohj | COP | Dihydrofolate reductase | 1.5.1.3 | 0.457 | |
1pwl | BFI | Aldose reductase | 1.1.1.21 | 0.457 | |
3gyf | 51P | Dihydrofolate reductase | 1.5.1.3 | 0.457 | |
3zec | ANP | Adenosine monophosphate-protein transferase SoFic | 2.7.7.n1 | 0.457 | |
4bbh | YBN | Glycylpeptide N-tetradecanoyltransferase | / | 0.457 | |
1jum | BER | HTH-type transcriptional regulator QacR | / | 0.456 | |
2pdn | 47D | Aldose reductase | 1.1.1.21 | 0.456 | |
3f3y | 4OA | Bile salt sulfotransferase | 2.8.2.14 | 0.456 | |
4b13 | X25 | Glycylpeptide N-tetradecanoyltransferase | / | 0.456 | |
1uho | VDN | cGMP-specific 3',5'-cyclic phosphodiesterase | / | 0.455 | |
2yne | YNE | Glycylpeptide N-tetradecanoyltransferase | / | 0.455 | |
4a32 | 2CD | Glycylpeptide N-tetradecanoyltransferase | / | 0.455 | |
4bfu | ZVU | Pantothenate kinase | 2.7.1.33 | 0.455 | |
4nv1 | 0FX | Formyl transferase | / | 0.455 | |
4xo7 | ASD | Aldo-keto reductase family 1 member C2 | / | 0.455 | |
1drf | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.454 | |
1odc | A8B | Acetylcholinesterase | 3.1.1.7 | 0.454 | |
2ckm | AA7 | Acetylcholinesterase | 3.1.1.7 | 0.454 | |
3pz3 | PZ3 | Geranylgeranyl transferase type-2 subunit beta | 2.5.1.60 | 0.454 | |
3zoi | M2W | Isopenicillin N synthase | 1.21.3.1 | 0.454 | |
2pb1 | NFG | Glucan 1,3-beta-glucosidase | / | 0.453 | |
2vi5 | Y19 | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.453 | |
1h22 | E10 | Acetylcholinesterase | 3.1.1.7 | 0.452 | |
2acl | L05 | Oxysterols receptor LXR-alpha | / | 0.452 | |
2pdb | ZST | Aldose reductase | 1.1.1.21 | 0.452 | |
2xlp | NAP | Putative flavin-containing monooxygenase | / | 0.452 | |
3k3h | BYE | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.452 | |
3t42 | 3T4 | Aldose reductase | 1.1.1.21 | 0.452 | |
3ntz | 3TZ | Dihydrofolate reductase | 1.5.1.3 | 0.451 | |
3u5y | SCG | Raucaffricine-O-beta-D-glucosidase | 3.2.1.125 | 0.451 | |
2xlt | NA0 | Putative flavin-containing monooxygenase | / | 0.450 | |
3hxe | BD8 | Geranylgeranyl transferase type-2 subunit beta | 2.5.1.60 | 0.450 | |
3wi2 | P98 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.450 | |
4a95 | 9MT | Glycylpeptide N-tetradecanoyltransferase | / | 0.450 | |
4bft | ZVT | Pantothenate kinase | 2.7.1.33 | 0.450 | |
4m6l | 21V | Dihydrofolate reductase | 1.5.1.3 | 0.450 | |
1ejb | INJ | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.449 | |
2pdc | 393 | Aldose reductase | 1.1.1.21 | 0.449 | |
2wnb | C5P | CMP-N-acetylneuraminate-beta-galactosamide-alpha-2,3-sialyltransferase 1 | 2.4.99.4 | 0.449 | |
2wzy | SQX | Soluble acetylcholine receptor | / | 0.449 | |
2xug | TZ4 | Acetylcholinesterase | 3.1.1.7 | 0.449 | |
3jsx | CC2 | NAD(P)H dehydrogenase [quinone] 1 | 1.6.5.2 | 0.448 | |
3n0h | TOP | Dihydrofolate reductase | 1.5.1.3 | 0.448 | |
3sfy | 3FY | Uncharacterized protein | / | 0.448 | |
4mqt | 2CU | Muscarinic acetylcholine receptor M2 | / | 0.448 | |
1isg | AGS | ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 2 | 3.2.2.6 | 0.447 | |
2a57 | CRM | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.447 | |
2bjs | ACV | Isopenicillin N synthase | 1.21.3.1 | 0.447 | |
2f38 | 15M | Aldo-keto reductase family 1 member C3 | / | 0.447 | |
2ikh | LIT | Aldose reductase | 1.1.1.21 | 0.447 | |
2w3m | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.447 | |
3cv7 | C2U | Alcohol dehydrogenase [NADP(+)] | 1.1.1.2 | 0.447 | |
3h4g | FID | Alcohol dehydrogenase [NADP(+)] | 1.1.1.2 | 0.447 | |
1efy | BZC | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.446 | |
1eve | E20 | Acetylcholinesterase | 3.1.1.7 | 0.446 | |
1kyx | CRM | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.446 | |
1pd9 | CO4 | Dihydrofolate reductase | 1.5.1.3 | 0.446 | |
1xf0 | ASD | Aldo-keto reductase family 1 member C3 | / | 0.446 | |
2fb8 | 215 | Serine/threonine-protein kinase B-raf | 2.7.11.1 | 0.446 | |
2gg3 | U13 | Methionine aminopeptidase | / | 0.446 | |
2ouu | 35G | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.446 | |
2pzj | NAD | Putative nucleotide sugar epimerase/ dehydratase | / | 0.446 | |
2w6c | BM4 | Acetylcholinesterase | 3.1.1.7 | 0.446 | |
3tfj | THG | Dimethylsulfonioproprionate demethylase DmdA | 2.1.1.269 | 0.446 | |
1fvp | FMA | Non-fluorescent flavoprotein | / | 0.445 | |
1zgc | A2E | Acetylcholinesterase | 3.1.1.7 | 0.445 | |
2pdq | 47D | Aldose reductase | 1.1.1.21 | 0.445 | |
4m6k | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.445 | |
1e1f | PSG | 4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl glucoside beta-D-glucosidase 1, chloroplastic | 3.2.1.182 | 0.444 | |
1hb3 | SCV | Isopenicillin N synthase | 1.21.3.1 | 0.444 | |
1sg0 | STL | Ribosyldihydronicotinamide dehydrogenase [quinone] | / | 0.444 | |
2aov | C2M | Histamine N-methyltransferase | 2.1.1.8 | 0.444 | |
3c3x | NAP | Eugenol synthase 1 | 1.1.1.318 | 0.444 | |
3cmf | PDN | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.444 | |
3qpo | PFR | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.444 | |
4c2z | 646 | Glycylpeptide N-tetradecanoyltransferase 1 | / | 0.444 | |
1qiq | ACC | Isopenicillin N synthase | 1.21.3.1 | 0.443 | |
1w29 | TS1 | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.443 | |
2vqz | MGT | Polymerase basic protein 2 | / | 0.443 | |
2wsa | 646 | Glycylpeptide N-tetradecanoyltransferase | / | 0.443 | |
2xuh | TZ4 | Acetylcholinesterase | 3.1.1.7 | 0.443 | |
2xuj | TZ5 | Acetylcholinesterase | 3.1.1.7 | 0.443 | |
4dbs | 0HV | Aldo-keto reductase family 1 member C3 | / | 0.443 | |
4gts | 7TP | Geranylgeranyl transferase type-2 subunit beta | 2.5.1.60 | 0.443 | |
4j7h | TRH | PCZA361.3 | / | 0.443 | |
4jpg | 1OX | Pyruvate kinase PKM | 2.7.1.40 | 0.443 | |
4qa2 | SHH | Histone deacetylase 8 | 3.5.1.98 | 0.443 | |
1s1r | NAP | Aldo-keto reductase family 1 member C3 | / | 0.442 | |
1xor | ZAR | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.442 | |
2vqq | TFG | Histone deacetylase 4 | 3.5.1.98 | 0.442 | |
3itu | IBM | cGMP-dependent 3',5'-cyclic phosphodiesterase | 3.1.4.17 | 0.442 | |
3syt | NAD | Glutamine-dependent NAD(+) synthetase | 6.3.5.1 | 0.442 | |
3uzx | AOM | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.442 | |
1p0p | BCH | Cholinesterase | 3.1.1.8 | 0.441 | |
2d06 | EST | Sulfotransferase 1A1 | 2.8.2.1 | 0.441 | |
2j3q | TFL | Acetylcholinesterase | 3.1.1.7 | 0.441 | |
2y0j | AXC | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.441 | |
3c1o | NAP | Eugenol synthase | / | 0.441 | |
3uwe | VJJ | Aldo-keto reductase family 1 member C3 | / | 0.441 | |
4ajm | 3A6 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.441 | |
4f0e | 0RU | Poly [ADP-ribose] polymerase 15 | 2.4.2.30 | 0.441 | |
1fap | RAP | Peptidyl-prolyl cis-trans isomerase FKBP1A | 5.2.1.8 | 0.440 | |
1fap | RAP | Serine/threonine-protein kinase mTOR | 2.7.11.1 | 0.440 | |
1obn | ASV | Isopenicillin N synthase | 1.21.3.1 | 0.440 | |
1ry0 | PG2 | Aldo-keto reductase family 1 member C3 | / | 0.440 | |
2r7n | ADP | 5-formaminoimidazole-4-carboxamide-1-(beta)-D-ribofuranosyl 5'-monophosphate synthetase | / | 0.440 | |
2xui | TZ5 | Acetylcholinesterase | 3.1.1.7 | 0.440 | |
3g1r | FIT | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.440 | |
3g4i | D71 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.440 | |
3l3r | OAG | Dihydrofolate reductase | 1.5.1.3 | 0.440 | |
3zky | WT4 | Isopenicillin N synthase | 1.21.3.1 | 0.440 | |
4c1i | EH9 | cGMP-dependent 3',5'-cyclic phosphodiesterase | 3.1.4.17 | 0.440 | |
4hhz | 15S | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.440 | |
4kfj | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.440 |