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sc-PDB

An Annotated Database of Druggable Binding Sites from the Protein DataBank

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Distribution of Interaction pattern similarity measured by Grim
You can zoom onto the graph by using the mouse to make a selection

Binding Modes are compared using Grim.
For more information, please see the following publication: Desaphy J. et al. Encoding Protein-Ligand Interaction Patterns in Fingerprints and Graphs J. Chem. Inf. Model., 2013, 53 (3), pp 623-637
Binding modes are considered as similar when the similarity value is greater than 0.65


Reference Protein Data Bank Entry :
PDB ID HET Uniprot Name EC Number
2he5 NDP Aldo-keto reductase family 1 member C21 1.1.1

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity		 Align
2he5 NDPAldo-keto reductase family 1 member C21 1.1.1 1.123
2hej NDPAldo-keto reductase family 1 member C21 1.1.1 0.836
2bgs NDPAldose reductase 1.1.1.21 0.758
5c7h NDPPutative oxidoreductase / 0.757
3uzw NAP3-oxo-5-beta-steroid 4-dehydrogenase / 0.750
2pfh NDPAldose reductase 1.1.1.21 0.747
1s1p NAPAldo-keto reductase family 1 member C3 / 0.743
4jtq NAPAldo-keto reductase family 1 member C2 / 0.742
3wg6 NDPNADPH-dependent conjugated polyketone reductase C1 / 0.741
4ijr NDPD-arabinose dehydrogenase [NAD(P)+] heavy chain 1.1.1.117 0.741
3h7r NAPAldo-keto reductase family 4 member C8 / 0.740
1q5m NDPProstaglandin-E(2) 9-reductase 1.1.1.189 0.733
1mi3 NADNAD(P)H-dependent D-xylose reductase 1.1.1.307 0.732
1k8c NAPNAD(P)H-dependent D-xylose reductase 1.1.1.307 0.731
4dz5 NAPAldo-keto reductase family 1 member C3 / 0.726
2iq0 NAPAldose reductase 1.1.1.21 0.719
1lwi NAP3-alpha-hydroxysteroid dehydrogenase 1.1.1.50 0.717
1ye4 NADNAD(P)H-dependent D-xylose reductase 1.1.1.307 0.717
1ye6 NAPNAD(P)H-dependent D-xylose reductase 1.1.1.307 0.717
2pf8 NDPAldose reductase 1.1.1.21 0.716
3h7u NAPNADPH-dependent aldo-keto reductase, chloroplastic / 0.715
1z8a NAPAldose reductase 1.1.1.21 0.711
2pev NDPAldose reductase 1.1.1.21 0.711
3q67 NAPAldose reductase 1.1.1.21 0.711
1r38 NAPNAD(P)H-dependent D-xylose reductase 1.1.1.307 0.707
1s1r NAPAldo-keto reductase family 1 member C3 / 0.707
2j8t NAPAldose reductase 1.1.1.21 0.707
3ln3 NADAldo-keto reductase family 1 member C13 / 0.707
4pmj NAPPutative oxidoreductase / 0.707
2vdg NDPAldose reductase 1.1.1.21 0.706
1vp5 NAPOxidoreductase, aldo/keto reductase family / 0.704
3buv NAP3-oxo-5-beta-steroid 4-dehydrogenase / 0.703
1c9w NAPAldose reductase-related protein 2 / 0.701
4jq3 NAPAldo-keto reductase family 1 member C2 / 0.700
2c91 NAPAflatoxin B1 aldehyde reductase member 2 / 0.699
1sm9 NADNAD(P)H-dependent D-xylose reductase 1.1.1.307 0.694
1hqt NAPAlcohol dehydrogenase [NADP(+)] 1.1.1.2 0.693
1x98 NAPAldose reductase 1.1.1.21 0.691
2hdj NDPAldo-keto reductase family 1 member C2 / 0.687
3caq NDP3-oxo-5-beta-steroid 4-dehydrogenase / 0.686
2acs NAPAldose reductase 1.1.1.21 0.685
2bp1 NDPAflatoxin B1 aldehyde reductase member 2 / 0.682
2acq NAPAldose reductase 1.1.1.21 0.680
1a80 NDP2,5-diketo-D-gluconic acid reductase A 1.1.1.346 0.678
1pz1 NAPGeneral stress protein 69 / 0.677
4jta NAPVoltage-gated potassium channel subunit beta-2 / 0.677
1lqa NDPProtein tas / 0.676
4h8n NDPNADPH-dependent conjugated polyketone reductase C2 / 0.675
4aub NAPL-glyceraldehyde 3-phosphate reductase 1.1.1 0.674
1ef3 NAPAldose reductase 1.1.1.21 0.673
4xo7 NAPAldo-keto reductase family 1 member C2 / 0.672
3v36 NAPAldose reductase 1.1.1.21 0.671
2fvl NAPAldo-keto reductase family 1 member C4 1.1.1.225 0.668
4jtd NAPVoltage-gated potassium channel subunit beta-2 / 0.667
2clp NDPAflatoxin B1 aldehyde reductase member 3 / 0.662
1gve NAPAflatoxin B1 aldehyde reductase member 3 1 0.657
4g5d NDPProstaglandin F synthase 1.1.1.188 0.656
3wcz NAPAldo-keto reductase AKR2E4 / 0.652
4xzn NAPAldo-keto reductase family 1 member B10 1.1.1 0.651
3n82 NADAldehyde dehydrogenase, mitochondrial 1.2.1.3 0.650