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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
1mi3 NAD NAD(P)H-dependent D-xylose reductase 1.1.1.307

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
1mi3 NADNAD(P)H-dependent D-xylose reductase 1.1.1.307 1.403
1r38 NAPNAD(P)H-dependent D-xylose reductase 1.1.1.307 1.168
1sm9 NADNAD(P)H-dependent D-xylose reductase 1.1.1.307 1.167
1z9a NADNAD(P)H-dependent D-xylose reductase 1.1.1.307 1.147
1ye4 NADNAD(P)H-dependent D-xylose reductase 1.1.1.307 1.133
1k8c NAPNAD(P)H-dependent D-xylose reductase 1.1.1.307 1.027
1ye6 NADNAD(P)H-dependent D-xylose reductase 1.1.1.307 0.957
2j8t NAPAldose reductase 1.1.1.21 0.954
1z8a NAPAldose reductase 1.1.1.21 0.925
2hdj NDPAldo-keto reductase family 1 member C2 / 0.913
2pf8 NDPAldose reductase 1.1.1.21 0.910
4ijr NDPD-arabinose dehydrogenase [NAD(P)+] heavy chain 1.1.1.117 0.906
4jq3 NAPAldo-keto reductase family 1 member C2 / 0.905
1s1p NAPAldo-keto reductase family 1 member C3 / 0.904
2pev NDPAldose reductase 1.1.1.21 0.894
3q65 NAPAldose reductase 1.1.1.21 0.894
2acq NAPAldose reductase 1.1.1.21 0.892
1ads NAPAldose reductase 1.1.1.21 0.888
1ye6 NAPNAD(P)H-dependent D-xylose reductase 1.1.1.307 0.888
3h7u NAPNADPH-dependent aldo-keto reductase, chloroplastic / 0.881
1x98 NAPAldose reductase 1.1.1.21 0.880
3q67 NAPAldose reductase 1.1.1.21 0.875
1x96 NAPAldose reductase 1.1.1.21 0.873
3wg6 NDPNADPH-dependent conjugated polyketone reductase C1 / 0.867
3uzw NAP3-oxo-5-beta-steroid 4-dehydrogenase / 0.864
4dz5 NAPAldo-keto reductase family 1 member C3 / 0.861
3v36 NAPAldose reductase 1.1.1.21 0.855
1c9w NAPAldose reductase-related protein 2 / 0.849
4g5d NDPProstaglandin F synthase 1.1.1.188 0.845
1ah4 NAPAldose reductase 1.1.1.21 0.838
2acs NAPAldose reductase 1.1.1.21 0.836
4xo7 NAPAldo-keto reductase family 1 member C2 / 0.833
1q5m NDPProstaglandin-E(2) 9-reductase 1.1.1.189 0.821
1gve NAPAflatoxin B1 aldehyde reductase member 3 1 0.818
2pfh NDPAldose reductase 1.1.1.21 0.817
4l1x NAPAldo-keto reductase family 1 member C2 / 0.817
2bp1 NDPAflatoxin B1 aldehyde reductase member 2 / 0.814
3bv7 NAP3-oxo-5-beta-steroid 4-dehydrogenase / 0.814
2acu NAPAldose reductase 1.1.1.21 0.809
4jtq NAPAldo-keto reductase family 1 member C2 / 0.807
4pmj NAPPutative oxidoreductase / 0.801
2bgs NDPAldose reductase 1.1.1.21 0.789
3g1r NAP3-oxo-5-beta-steroid 4-dehydrogenase / 0.787
1ef3 NAPAldose reductase 1.1.1.21 0.786
4xzn NAPAldo-keto reductase family 1 member B10 1.1.1 0.782
2iq0 NAPAldose reductase 1.1.1.21 0.779
1zgd NAPChalcone reductase / 0.766
3buv NAP3-oxo-5-beta-steroid 4-dehydrogenase / 0.766
3ln3 NADAldo-keto reductase family 1 member C13 / 0.765
1a80 NDP2,5-diketo-D-gluconic acid reductase A 1.1.1.346 0.753
1lqa NDPProtein tas / 0.751
3h7r NAPAldo-keto reductase family 4 member C8 / 0.750
4xzm NAPAldo-keto reductase family 1 member B10 1.1.1 0.750
3dop NAP3-oxo-5-beta-steroid 4-dehydrogenase / 0.748
3o3r NAPAldose reductase-related protein 1 1.1.1.21 0.748
1m9h NAD2,5-diketo-D-gluconic acid reductase A 1.1.1.346 0.745
1hqt NAPAlcohol dehydrogenase [NADP(+)] 1.1.1.2 0.744
4jta NAPVoltage-gated potassium channel subunit beta-2 / 0.743
1s1r NAPAldo-keto reductase family 1 member C3 / 0.740
2clp NDPAflatoxin B1 aldehyde reductase member 3 / 0.737
1az2 NAPAldose reductase 1.1.1.21 0.732
2he5 NDPAldo-keto reductase family 1 member C21 1.1.1 0.732
2vdg NDPAldose reductase 1.1.1.21 0.729
3qkz NAPAldose reductase-related protein 1 1.1.1.21 0.728
5c7h NDPPutative oxidoreductase / 0.724
3wcz NAPAldo-keto reductase AKR2E4 / 0.714
2hej NDPAldo-keto reductase family 1 member C21 1.1.1 0.710
1og6 NAPOxidoreductase YdhF 1 0.709
3caq NDP3-oxo-5-beta-steroid 4-dehydrogenase / 0.708
1lwi NAP3-alpha-hydroxysteroid dehydrogenase 1.1.1.50 0.702
1vp5 NAPOxidoreductase, aldo/keto reductase family / 0.701
1pz0 NAPProtein IolS 1.1.1 0.698
2c91 NAPAflatoxin B1 aldehyde reductase member 2 / 0.694
4h8n NDPNADPH-dependent conjugated polyketone reductase C2 / 0.679
1qrq NDPVoltage-gated potassium channel subunit beta-2 / 0.676
4aub NAPL-glyceraldehyde 3-phosphate reductase 1.1.1 0.667
3lut NAPVoltage-gated potassium channel subunit beta-2 / 0.665
3lnm NAPVoltage-gated potassium channel subunit beta-2 / 0.663
2fvl NAPAldo-keto reductase family 1 member C4 1.1.1.225 0.660
4jtd NAPVoltage-gated potassium channel subunit beta-2 / 0.660
2p5n NDPAldo-keto reductase family 1 member C21 1.1.1 0.659