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 |
---|---|---|---|
4kmz | FOL | Folate receptor beta |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
4kmz | FOL | Folate receptor beta | / | 1.000 | |
4lrh | FOL | Folate receptor alpha | / | 0.616 | |
4kn0 | MTX | Folate receptor beta | / | 0.613 | |
4kn1 | 04J | Folate receptor beta | / | 0.601 | |
4kn2 | LYA | Folate receptor beta | / | 0.570 | |
1ry0 | PG2 | Aldo-keto reductase family 1 member C3 | / | 0.471 | |
1s36 | CEI | Obelin | / | 0.457 | |
3d4s | TIM | Beta-2 adrenergic receptor | / | 0.450 | |
1ry8 | RUT | Aldo-keto reductase family 1 member C3 | / | 0.449 | |
4b11 | 7I1 | Glycylpeptide N-tetradecanoyltransferase | / | 0.448 | |
5std | UNN | Scytalone dehydratase | 4.2.1.94 | 0.448 | |
1uho | VDN | cGMP-specific 3',5'-cyclic phosphodiesterase | / | 0.447 | |
2xuh | TZ4 | Acetylcholinesterase | 3.1.1.7 | 0.447 | |
3bv7 | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.447 | |
4bj9 | UHB | Tankyrase-2 | 2.4.2.30 | 0.447 | |
1udt | VIA | cGMP-specific 3',5'-cyclic phosphodiesterase | / | 0.446 | |
4a95 | 9MT | Glycylpeptide N-tetradecanoyltransferase | / | 0.444 | |
1gt5 | BZQ | Odorant-binding protein | / | 0.442 | |
3uzw | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.442 | |
4pnm | NU1 | Tankyrase-2 | 2.4.2.30 | 0.442 | |
2aou | CQA | Histamine N-methyltransferase | 2.1.1.8 | 0.441 | |
2cek | N8T | Acetylcholinesterase | 3.1.1.7 | 0.440 | |
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 | 0.440 |