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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
4xznNAPAldo-keto reductase family 1 member B101.1.1

Complex with similar cavities

PDB ID HET Uniprot Name EC Number Cavity
Similarity		 Align
4xznNAPAldo-keto reductase family 1 member B101.1.11.000
4xzmNAPAldo-keto reductase family 1 member B101.1.10.604
2j8tNAPAldose reductase1.1.1.210.529
3wbwNDPPutative 2,5-diketo-D-gluconic acid reductase/0.529
2vdgNDPAldose reductase1.1.1.210.528
1x96NAPAldose reductase1.1.1.210.518
2iq0NAPAldose reductase1.1.1.210.514
4h8nNDPNADPH-dependent conjugated polyketone reductase C2/0.512
1ah4NAPAldose reductase1.1.1.210.507
4g5dNDPProstaglandin F synthase1.1.1.1880.506
2acqNAPAldose reductase1.1.1.210.499
2pevNDPAldose reductase1.1.1.210.497
1x98NAPAldose reductase1.1.1.210.490
3v36NAPAldose reductase1.1.1.210.480
4pmjNAPPutative oxidoreductase/0.477
3uzwNAP3-oxo-5-beta-steroid 4-dehydrogenase/0.468
1k8cNAPNAD(P)H-dependent D-xylose reductase1.1.1.3070.467
3h7uNAPNADPH-dependent aldo-keto reductase, chloroplastic/0.465
1z8aNAPAldose reductase1.1.1.210.463
1ef3NAPAldose reductase1.1.1.210.462
1adsNAPAldose reductase1.1.1.210.461
5c7hNDPPutative oxidoreductase/0.458
3q65NAPAldose reductase1.1.1.210.456
3buvNAP3-oxo-5-beta-steroid 4-dehydrogenase/0.451
3g1rNAP3-oxo-5-beta-steroid 4-dehydrogenase/0.446
1r38NAPNAD(P)H-dependent D-xylose reductase1.1.1.3070.443
1a80NDP2,5-diketo-D-gluconic acid reductase A1.1.1.3460.440