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 |
---|---|---|---|
4igf | CHV | Enoyl-acyl carrier reductase |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
4igf | CHV | Enoyl-acyl carrier reductase | / | 1.000 | |
1d7o | TCL | Enoyl-[acyl-carrier-protein] reductase [NADH], chloroplastic | 1.3.1.9 | 0.535 | |
4x5f | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.472 | |
1j3j | CP6 | Bifunctional dihydrofolate reductase-thymidylate synthase | 1.5.1.3 | 0.469 | |
4rlh | 0WE | Enoyl-[acyl-carrier-protein] reductase [NADH] | / | 0.469 | |
1y2c | 3DE | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.466 | |
2e0n | SAH | Precorrin-2 C20-methyltransferase | / | 0.460 | |
3m2u | COM | Methyl-coenzyme M reductase I subunit alpha | 2.8.4.1 | 0.460 | |
2ga2 | A19 | Methionine aminopeptidase 2 | / | 0.459 | |
4hcy | 0YN | Transketolase | / | 0.457 | |
1dr3 | HBI | Dihydrofolate reductase | 1.5.1.3 | 0.456 | |
4g09 | 0VD | Histidinol dehydrogenase | / | 0.455 | |
1f20 | FAD | Nitric oxide synthase, brain | 1.14.13.39 | 0.453 | |
1y2d | 4DE | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.452 | |
3cgt | BCD | Cyclomaltodextrin glucanotransferase | 2.4.1.19 | 0.452 | |
4uwm | FMN | 3,6-diketocamphane 1,6 monooxygenase | 1.14.13 | 0.452 | |
1rne | C60 | Renin | 3.4.23.15 | 0.451 | |
2xuf | TZ4 | Acetylcholinesterase | 3.1.1.7 | 0.451 | |
3fnh | JPJ | Enoyl-[acyl-carrier-protein] reductase [NADH] | 1.3.1.9 | 0.451 | |
4tzk | 641 | Enoyl-[acyl-carrier-protein] reductase [NADH] | 1.3.1.9 | 0.451 | |
3dy8 | 5GP | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.450 | |
3ele | PLP | Aminotransferase | / | 0.449 | |
4bfx | ZVX | Pantothenate kinase | 2.7.1.33 | 0.449 | |
1pax | DHQ | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.448 | |
3h3q | H13 | Collagen type IV alpha-3-binding protein | / | 0.448 | |
3v2b | AR6 | Poly [ADP-ribose] polymerase 15 | 2.4.2.30 | 0.448 | |
4g95 | OAG | Dihydrofolate reductase | 1.5.1.3 | 0.448 | |
1blz | ACV | Isopenicillin N synthase | 1.21.3.1 | 0.447 | |
1mvs | DTM | Dihydrofolate reductase | 1.5.1.3 | 0.447 | |
2b37 | 8PS | Enoyl-[acyl-carrier-protein] reductase [NADH] | 1.3.1.9 | 0.446 | |
4mv1 | ADP | Biotin carboxylase | 6.3.4.14 | 0.446 | |
4o1m | NAD | Enoyl-acyl carrier reductase | / | 0.446 | |
5cc9 | DDF | Dihydrofolate reductase | 1.5.1.3 | 0.446 | |
1uzw | CDH | Isopenicillin N synthase | 1.21.3.1 | 0.445 | |
1xe6 | 5FP | Plasmepsin-2 | 3.4.23.39 | 0.444 | |
1dr5 | NAP | Dihydrofolate reductase | 1.5.1.3 | 0.443 | |
1p0p | BCH | Cholinesterase | 3.1.1.8 | 0.443 | |
2ea2 | F77 | Methionine aminopeptidase 2 | / | 0.443 | |
4b7z | Q4Q | Acetylcholinesterase | 3.1.1.7 | 0.443 | |
5fd8 | A5A | Putative carboxypeptidase yocD | / | 0.443 | |
2jn3 | JN3 | Fatty acid-binding protein, liver | / | 0.442 | |
3oaf | OAG | Dihydrofolate reductase | 1.5.1.3 | 0.442 | |
4kby | C2E | Stimulator of interferon genes protein | / | 0.442 | |
2ea4 | F79 | Methionine aminopeptidase 2 | / | 0.441 | |
2g1o | 2IG | Renin | 3.4.23.15 | 0.441 | |
3s3v | TOP | Dihydrofolate reductase | 1.5.1.3 | 0.441 | |
3sn7 | 540 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.441 | |
4tjy | 3GN | Tankyrase-2 | 2.4.2.30 | 0.441 | |
1eno | NAD | Enoyl-[acyl-carrier-protein] reductase [NADH], chloroplastic | 1.3.1.9 | 0.440 | |
1qiq | ACC | Isopenicillin N synthase | 1.21.3.1 | 0.440 | |
2xuo | TZ4 | Acetylcholinesterase | 3.1.1.7 | 0.440 | |
3m30 | COM | Methyl-coenzyme M reductase I subunit alpha | 2.8.4.1 | 0.440 | |
3m30 | COM | Methyl-coenzyme M reductase I subunit beta | 2.8.4.1 | 0.440 |