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sc-PDB

An Annotated Database of Druggable Binding Sites from the Protein DataBank

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Distribution of Cavity similarities measured by Shaper
You can zoom onto the graph by using the mouse to make a selection

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

Reference Protein Data Bank Entry :
PDB ID HET Uniprot Name EC Number
4xymCOAAcyl-CoA synthetase (NDP forming)

Complex with similar cavities

PDB ID HET Uniprot Name EC Number Cavity
Similarity		 Align
4xymCOAAcyl-CoA synthetase (NDP forming)/1.000
5hbrCOAAcyl-CoA synthetase (NDP forming)/0.611
4y8vADPAcyl-CoA synthetase (NDP forming)/0.530
4yakCOAAcyl-CoA synthetase (NDP forming)/0.526
4yakACOAcyl-CoA synthetase (NDP forming)/0.487
4xz3COAAcyl-CoA synthetase (NDP forming)/0.463