Cavities 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
| PDB ID | HET | Uniprot Name | EC Number |
|---|---|---|---|
| 2pdl | TOL | Aldose reductase | 1.1.1.21 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 2pdl | TOL | Aldose reductase | 1.1.1.21 | 1.000 | |
| 2fzb | TOL | Aldose reductase | 1.1.1.21 | 0.637 | |
| 1ah3 | TOL | Aldose reductase | 1.1.1.21 | 0.629 | |
| 2fzd | TOL | Aldose reductase | 1.1.1.21 | 0.593 | |
| 2pdh | 47D | Aldose reductase | 1.1.1.21 | 0.583 | |
| 2pdf | ZST | Aldose reductase | 1.1.1.21 | 0.569 | |
| 1zua | TOL | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.530 | |
| 3ghr | LDT | Aldose reductase | 1.1.1.21 | 0.530 | |
| 2fz8 | ZST | Aldose reductase | 1.1.1.21 | 0.529 | |
| 2i16 | LDT | Aldose reductase | 1.1.1.21 | 0.518 | |
| 4wev | SUZ | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.509 | |
| 3ghs | LDT | Aldose reductase | 1.1.1.21 | 0.503 | |
| 2duz | ZST | Aldose reductase | 1.1.1.21 | 0.491 | |
| 2dv0 | ZST | Aldose reductase | 1.1.1.21 | 0.486 | |
| 3ght | LDT | Aldose reductase | 1.1.1.21 | 0.486 | |
| 2hv5 | ZST | Aldose reductase | 1.1.1.21 | 0.483 | |
| 3m64 | 393 | Aldose reductase | 1.1.1.21 | 0.479 | |
| 1ry0 | PG2 | Aldo-keto reductase family 1 member C3 | / | 0.475 | |
| 1z89 | 62P | Aldose reductase | 1.1.1.21 | 0.474 | |
| 2fz9 | ZST | Aldose reductase | 1.1.1.21 | 0.474 | |
| 2ikj | 393 | Aldose reductase | 1.1.1.21 | 0.473 | |
| 4pnm | NU1 | Tankyrase-2 | 2.4.2.30 | 0.472 | |
| 1z3n | 3NA | Aldose reductase | 1.1.1.21 | 0.471 | |
| 2i17 | LDT | Aldose reductase | 1.1.1.21 | 0.470 | |
| 2hvo | ZST | Aldose reductase | 1.1.1.21 | 0.469 | |
| 2pzn | 393 | Aldose reductase | 1.1.1.21 | 0.467 | |
| 1zq5 | E04 | Aldo-keto reductase family 1 member C3 | / | 0.466 | |
| 5liu | 388 | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.466 | |
| 3ld5 | LDT | Aldose reductase | 1.1.1.21 | 0.465 | |
| 2iki | 388 | Aldose reductase | 1.1.1.21 | 0.464 | |
| 3aiq | HBO | 4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl glucoside beta-D-glucosidase 1b, chloroplastic | 3.2.1.182 | 0.464 | |
| 4ajm | 3A6 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.463 | |
| 2fm5 | M99 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.462 | |
| 3ghu | LDT | Aldose reductase | 1.1.1.21 | 0.461 | |
| 3dop | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.460 | |
| 3r43 | ID8 | Aldo-keto reductase family 1 member C3 | / | 0.460 | |
| 4fam | 0SZ | Aldo-keto reductase family 1 member C3 | / | 0.458 | |
| 4gca | 2X9 | Aldose reductase | 1.1.1.21 | 0.458 | |
| 3len | ZST | Aldose reductase | 1.1.1.21 | 0.456 | |
| 1zkl | IBM | High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A | 3.1.4.53 | 0.454 | |
| 3aiv | HBO | 4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl glucoside beta-D-glucosidase, chloroplastic | 3.2.1.182 | 0.452 | |
| 2f38 | 15M | Aldo-keto reductase family 1 member C3 | / | 0.451 | |
| 2ikh | LIT | Aldose reductase | 1.1.1.21 | 0.451 | |
| 2bjs | ACV | Isopenicillin N synthase | 1.21.3.1 | 0.449 | |
| 4mvh | 2F5 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.448 | |
| 1q5m | NDP | Prostaglandin-E(2) 9-reductase | 1.1.1.189 | 0.447 | |
| 3w5e | NVW | cAMP-specific 3',5'-cyclic phosphodiesterase 4B | 3.1.4.53 | 0.447 | |
| 2vbp | VB1 | Isopenicillin N synthase | 1.21.3.1 | 0.446 | |
| 3g5e | Q74 | Aldose reductase | 1.1.1.21 | 0.446 | |
| 1y2k | 7DE | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.445 | |
| 2pdp | 393 | Aldose reductase | 1.1.1.21 | 0.445 | |
| 2pdw | FID | Aldose reductase | 1.1.1.21 | 0.445 | |
| 2vrj | NCW | Beta-glucosidase A | 3.2.1.21 | 0.444 | |
| 4bbh | YBN | Glycylpeptide N-tetradecanoyltransferase | / | 0.444 | |
| 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 | 0.442 | |
| 4kxj | P34 | Nucleoprotein | / | 0.442 | |
| 2j7c | IDE | Beta-glucosidase A | 3.2.1.21 | 0.441 | |
| 3u5y | SCG | Raucaffricine-O-beta-D-glucosidase | 3.2.1.125 | 0.441 | |
| 3wav | DWV | Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 | 3.1.4.39 | 0.441 | |
| 2pdu | 393 | Aldose reductase | 1.1.1.21 | 0.440 | |
| 4fcb | 0T7 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.440 |