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 |
---|---|---|---|
2wba | FAD | Trypanothione reductase | 1.8.1.12 |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
2wba | FAD | Trypanothione reductase | 1.8.1.12 | 1.000 | |
2hqm | FAD | Glutathione reductase | 1.8.1.7 | 0.539 | |
1gxf | FAD | Trypanothione reductase | 1.8.1.12 | 0.526 | |
1fec | FAD | Trypanothione reductase | 1.8.1.12 | 0.504 | |
3dgz | FAD | Thioredoxin reductase 2, mitochondrial | 1.8.1.9 | 0.502 | |
3sqp | FAD | Glutathione reductase, mitochondrial | 1.8.1.7 | 0.501 | |
1bzl | FAD | Trypanothione reductase | 1.8.1.12 | 0.493 | |
2jk6 | FAD | Trypanothione reductase | / | 0.492 | |
1k4q | FAD | Glutathione reductase, mitochondrial | 1.8.1.7 | 0.487 | |
1tyt | FAD | Trypanothione reductase | 1.8.1.12 | 0.484 | |
4dna | FAD | Probable glutathione reductase | / | 0.482 | |
4nev | FAD | Trypanothione reductase | / | 0.473 | |
4la1 | FAD | Thioredoxin glutathione reductase | / | 0.469 | |
4j56 | FAD | Thioredoxin reductase 2 | 1.8.1.9 | 0.459 |