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 |
---|---|---|---|
3bej | MUF | Bile acid receptor |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
3bej | MUF | Bile acid receptor | / | 1.000 | |
3w5p | 4OA | Vitamin D3 receptor | / | 0.488 | |
2acw | UPG | Glycosyltransferase | / | 0.476 | |
2hcd | BIV | Vitamin D3 receptor A | / | 0.474 | |
2hnz | PC0 | Gag-Pol polyprotein | 2.7.7.49 | 0.473 | |
4itf | TFY | Vitamin D3 receptor | / | 0.471 | |
3w5r | LOA | Vitamin D3 receptor | / | 0.468 | |
4q0a | 4OA | Vitamin D3 receptor A | / | 0.467 | |
3vt3 | VDX | Vitamin D3 receptor | / | 0.464 | |
3w5t | LHP | Vitamin D3 receptor | / | 0.463 | |
4ite | TEY | Vitamin D3 receptor | / | 0.463 | |
2o4r | VD5 | Vitamin D3 receptor | / | 0.462 | |
3w0y | DS4 | Vitamin D3 receptor | / | 0.462 | |
2f4b | EHA | Peroxisome proliferator-activated receptor gamma | / | 0.461 | |
1rk3 | VDX | Vitamin D3 receptor | / | 0.460 | |
3up3 | XCA | aceDAF-12 | / | 0.460 | |
1rdt | 570 | Peroxisome proliferator-activated receptor gamma | / | 0.459 | |
2zlc | VDX | Vitamin D3 receptor | / | 0.459 | |
3w0a | DS5 | Vitamin D3 receptor | / | 0.459 | |
4xuh | SFI | Peroxisome proliferator-activated receptor gamma | / | 0.459 | |
1s19 | MC9 | Vitamin D3 receptor | / | 0.458 | |
3vt5 | YI2 | Vitamin D3 receptor | / | 0.458 | |
1zeo | C01 | Peroxisome proliferator-activated receptor gamma | / | 0.457 | |
2zb4 | 5OP | Prostaglandin reductase 2 | 1.3.1.48 | 0.457 | |
3w0i | O11 | Vitamin D3 receptor | / | 0.457 | |
2has | C3O | Vitamin D3 receptor | / | 0.456 | |
2i4z | DRH | Peroxisome proliferator-activated receptor gamma | / | 0.455 | |
3vt9 | YI4 | Vitamin D3 receptor | / | 0.455 | |
1y60 | H4M | 5,6,7,8-tetrahydromethanopterin hydro-lyase | 4.2.1.147 | 0.453 | |
2hc4 | VDX | Vitamin D3 receptor A | / | 0.453 | |
4g20 | 484 | Vitamin D3 receptor A | / | 0.453 | |
4g21 | 0VP | Vitamin D3 receptor A | / | 0.453 | |
1bq1 | CB3 | Thymidylate synthase | / | 0.452 | |
2hwr | DRD | Peroxisome proliferator-activated receptor gamma | / | 0.452 | |
3kdu | NKS | Peroxisome proliferator-activated receptor alpha | / | 0.452 | |
3vrw | YS5 | Vitamin D3 receptor | / | 0.452 | |
3vsp | EK8 | Peroxisome proliferator-activated receptor gamma | / | 0.452 | |
3w5q | 3KL | Vitamin D3 receptor | / | 0.452 | |
1fm9 | 570 | Peroxisome proliferator-activated receptor gamma | / | 0.451 | |
3hcr | CHD | Ferrochelatase, mitochondrial | 4.99.1.1 | 0.450 | |
1osv | CHC | Bile acid receptor | / | 0.449 | |
1ot7 | IU5 | Bile acid receptor | / | 0.449 | |
2ham | C33 | Vitamin D3 receptor | / | 0.449 | |
2hbh | XE4 | Vitamin D3 receptor A | / | 0.449 | |
3vjh | J35 | Peroxisome proliferator-activated receptor gamma | / | 0.449 | |
4g2h | 0VQ | Vitamin D3 receptor A | / | 0.449 | |
1knu | YPA | Peroxisome proliferator-activated receptor gamma | / | 0.447 | |
1l2j | ETC | Estrogen receptor beta | / | 0.447 | |
1txi | TX5 | Vitamin D3 receptor | / | 0.447 | |
3dr1 | C5D | Vitamin D3 receptor A | / | 0.446 | |
3vru | YS3 | Vitamin D3 receptor | / | 0.446 | |
4g1d | 0VK | Vitamin D3 receptor A | / | 0.446 | |
2har | OCC | Vitamin D3 receptor | / | 0.445 | |
2rc6 | NAP | Ferredoxin--NADP reductase | / | 0.445 | |
1rkg | VD1 | Vitamin D3 receptor | / | 0.444 | |
3u8h | BHP | Phospholipase A2, membrane associated | / | 0.444 | |
3up0 | D7S | aceDAF-12 | / | 0.444 | |
4ge7 | 0K5 | Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial | 2.6.1.39 | 0.444 | |
2hb7 | O1C | Vitamin D3 receptor | / | 0.443 | |
2jn3 | JN3 | Fatty acid-binding protein, liver | / | 0.443 | |
3v9y | 24L | Peroxisome proliferator-activated receptor gamma | / | 0.443 | |
3w0c | 6DS | Vitamin D3 receptor | / | 0.443 | |
4ia1 | BIV | Vitamin D3 receptor A | / | 0.443 | |
2qd3 | CHD | Ferrochelatase, mitochondrial | 4.99.1.1 | 0.442 | |
3kpz | ZNE | Vitamin D3 receptor | / | 0.442 | |
3vt7 | VDX | Vitamin D3 receptor | / | 0.442 | |
4fhi | 0S4 | Vitamin D3 receptor A | / | 0.442 | |
4g1y | 0VO | Vitamin D3 receptor A | / | 0.442 | |
1pq9 | 44B | Oxysterols receptor LXR-beta | / | 0.441 | |
2hb8 | MVD | Vitamin D3 receptor | / | 0.441 | |
2om9 | AJA | Peroxisome proliferator-activated receptor gamma | / | 0.441 | |
2w4q | CBW | Prostaglandin reductase 2 | 1.3.1.48 | 0.441 | |
3qlr | NDP | Dihydrofolate reductase | 1.5.1.3 | 0.441 | |
4ien | COA | Putative acyl-CoA hydrolase | / | 0.441 | |
3dga | NDP | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.440 | |
3l0l | HC3 | Nuclear receptor ROR-gamma | / | 0.440 | |
3vtc | TK3 | Vitamin D3 receptor | / | 0.440 | |
3w0j | T08 | Vitamin D3 receptor | / | 0.440 | |
4f9m | FCM | Peroxisome proliferator-activated receptor gamma | / | 0.440 |