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 |
---|---|---|---|
2fwn | TDP | Benzoylformate decarboxylase | 4.1.1.7 |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
2fwn | TDP | Benzoylformate decarboxylase | 4.1.1.7 | 1.000 | |
5dgt | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.683 | |
4ju8 | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.637 | |
1bfd | TPP | Benzoylformate decarboxylase | 4.1.1.7 | 0.611 | |
4mq5 | TPP | Benzoylformate decarboxylase | 4.1.1.7 | 0.611 | |
4ju9 | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.581 | |
4qel | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.572 | |
4juf | TPP | Benzoylformate decarboxylase | 4.1.1.7 | 0.570 | |
4k9n | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.566 | |
4jub | TPP | Benzoylformate decarboxylase | 4.1.1.7 | 0.538 | |
3fzn | D7K | Benzoylformate decarboxylase | 4.1.1.7 | 0.536 | |
4jd5 | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.519 | |
4mzx | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.504 | |
4gm0 | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.489 | |
4k9p | TPP | Benzoylformate decarboxylase | 4.1.1.7 | 0.488 | |
3ieu | GDP | GTPase Era | / | 0.474 | |
1la2 | NAD | Inositol-3-phosphate synthase | 5.5.1.4 | 0.442 | |
4gm1 | TZD | Benzoylformate decarboxylase | 4.1.1.7 | 0.440 |