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 |
---|---|---|---|
2fzd | TOL | Aldose reductase | 1.1.1.21 |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
2fzd | TOL | Aldose reductase | 1.1.1.21 | 1.000 | |
1ah3 | TOL | Aldose reductase | 1.1.1.21 | 0.611 | |
2pdl | TOL | Aldose reductase | 1.1.1.21 | 0.592 | |
2pdh | 47D | Aldose reductase | 1.1.1.21 | 0.562 | |
2pdx | ZST | Aldose reductase | 1.1.1.21 | 0.553 | |
1zua | TOL | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.551 | |
2fz9 | ZST | Aldose reductase | 1.1.1.21 | 0.549 | |
2pdf | ZST | Aldose reductase | 1.1.1.21 | 0.540 | |
4wev | SUZ | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.521 | |
2fzb | TOL | Aldose reductase | 1.1.1.21 | 0.518 | |
2dv0 | ZST | Aldose reductase | 1.1.1.21 | 0.507 | |
3m4h | 388 | Aldose reductase | 1.1.1.21 | 0.502 | |
4gca | 2X9 | Aldose reductase | 1.1.1.21 | 0.498 | |
5liu | 388 | Aldo-keto reductase family 1 member B10 | 1.1.1 | 0.496 | |
3lql | LDT | Aldose reductase | 1.1.1.21 | 0.495 | |
1z3n | 3NA | Aldose reductase | 1.1.1.21 | 0.494 | |
2hv5 | ZST | Aldose reductase | 1.1.1.21 | 0.491 | |
3lbo | LDT | Aldose reductase | 1.1.1.21 | 0.488 | |
3g5e | Q74 | Aldose reductase | 1.1.1.21 | 0.487 | |
3m64 | 393 | Aldose reductase | 1.1.1.21 | 0.479 | |
1z89 | 62P | Aldose reductase | 1.1.1.21 | 0.476 | |
3lz5 | LDT | Aldose reductase | 1.1.1.21 | 0.475 | |
2fz8 | ZST | Aldose reductase | 1.1.1.21 | 0.472 | |
4yu1 | 53N | Aldose reductase | 1.1.1.21 | 0.472 | |
3mb9 | ZST | Aldose reductase | 1.1.1.21 | 0.470 | |
1ry0 | PG2 | Aldo-keto reductase family 1 member C3 | / | 0.469 | |
1xor | ZAR | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.468 | |
3ghu | LDT | Aldose reductase | 1.1.1.21 | 0.467 | |
3itu | IBM | cGMP-dependent 3',5'-cyclic phosphodiesterase | 3.1.4.17 | 0.465 | |
3len | ZST | Aldose reductase | 1.1.1.21 | 0.465 | |
1w6j | R71 | Lanosterol synthase | 5.4.99.7 | 0.464 | |
2pdu | 393 | Aldose reductase | 1.1.1.21 | 0.464 | |
4y1b | NAP | AntE | / | 0.464 | |
3v35 | NTI | Aldose reductase | 1.1.1.21 | 0.463 | |
2hvo | ZST | Aldose reductase | 1.1.1.21 | 0.462 | |
2inz | OHP | Aldose reductase | 1.1.1.21 | 0.462 | |
3g4g | D71 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.462 | |
2pd9 | FID | Aldose reductase | 1.1.1.21 | 0.461 | |
2iki | 388 | Aldose reductase | 1.1.1.21 | 0.460 | |
1zq5 | E04 | Aldo-keto reductase family 1 member C3 | / | 0.458 | |
2ikj | 393 | Aldose reductase | 1.1.1.21 | 0.458 | |
2qxw | LDT | Aldose reductase | 1.1.1.21 | 0.458 | |
2fm5 | M99 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.457 | |
4kp6 | 1S1 | cAMP-specific 3',5'-cyclic phosphodiesterase 4B | 3.1.4.53 | 0.456 | |
2iqd | LPA | Aldose reductase | 1.1.1.21 | 0.455 | |
2pdj | 393 | Aldose reductase | 1.1.1.21 | 0.455 | |
3mc5 | 393 | Aldose reductase | 1.1.1.21 | 0.455 | |
2pdp | 393 | Aldose reductase | 1.1.1.21 | 0.454 | |
1y2c | 3DE | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.453 | |
3dyn | PCG | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.453 | |
4pnm | NU1 | Tankyrase-2 | 2.4.2.30 | 0.453 | |
1us0 | LDT | Aldose reductase | 1.1.1.21 | 0.452 | |
1y2e | 5DE | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.452 | |
1eko | I84 | Aldose reductase | 1.1.1.21 | 0.451 | |
1t41 | ID5 | Aldose reductase | 1.1.1.21 | 0.451 | |
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 | 0.451 | |
1zkl | IBM | High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A | 3.1.4.53 | 0.450 | |
2pdw | FID | Aldose reductase | 1.1.1.21 | 0.450 | |
3bv7 | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.450 | |
3k4s | 0MO | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.450 | |
2ipi | AKY | Aclacinomycin-N/aclacinomycin-A oxidase | / | 0.449 | |
2dux | ZST | Aldose reductase | 1.1.1.21 | 0.447 | |
2wo7 | ASV | Isopenicillin N synthase | 1.21.3.1 | 0.447 | |
2f2k | TGG | Aldose reductase | 1.1.1.21 | 0.446 | |
3zky | WT4 | Isopenicillin N synthase | 1.21.3.1 | 0.446 | |
1zgc | A2E | Acetylcholinesterase | 3.1.1.7 | 0.445 | |
2i16 | LDT | Aldose reductase | 1.1.1.21 | 0.445 | |
1xon | PIL | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.444 | |
2xeg | CI9 | Glutamate carboxypeptidase 2 | 3.4.17.21 | 0.444 | |
4fam | 0SZ | Aldo-keto reductase family 1 member C3 | / | 0.444 | |
4l1x | NAP | Aldo-keto reductase family 1 member C2 | / | 0.444 | |
1ry8 | RUT | Aldo-keto reductase family 1 member C3 | / | 0.443 | |
1bk0 | ACV | Isopenicillin N synthase | 1.21.3.1 | 0.442 | |
2vcm | M11 | Isopenicillin N synthase | 1.21.3.1 | 0.442 | |
3ghr | LDT | Aldose reductase | 1.1.1.21 | 0.442 | |
1n5v | NOM | ActVA 6 protein | / | 0.441 | |
1t40 | ID5 | Aldose reductase | 1.1.1.21 | 0.441 | |
2ouy | CMP | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.441 | |
1uho | VDN | cGMP-specific 3',5'-cyclic phosphodiesterase | / | 0.440 | |
2xvi | FAD | Putative flavin-containing monooxygenase | / | 0.440 | |
4hhy | 15R | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.440 |