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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
4gh5 NAD Short-chain dehydrogenase/reductase SDR

Complex with similar interaction patterns:

PDB ID HET Uniprot Name EC Number Binding Mode
Similarity
Align
4gh5 NADShort-chain dehydrogenase/reductase SDR / 1.143
1geg NADDiacetyl reductase [(S)-acetoin forming] 1.1.1.304 0.958
5ig2 NADShort-chain dehydrogenase/reductase SDR / 0.927
3nug NADPyridoxal 4-dehydrogenase 1.1.1.107 0.926
4fn4 NADShort chain dehydrogenase / 0.917
4wec NADShort chain dehydrogenase / 0.912
5jsf NAD17-beta-hydroxysteroid dehydrogenase 14 1.1.1 0.911
5js6 NAD17-beta-hydroxysteroid dehydrogenase 14 1.1.1 0.906
1g0n NDPTetrahydroxynaphthalene reductase 1.1.1.252 0.889
4z3d NDPCarbonyl reductase [NADPH] 1 1.1.1.184 0.887
4yag NAIC alpha-dehydrogenase / 0.886
3a28 NADL-2,3-butanediol dehydrogenase 1.1.1.76 0.873
4cql NADEstradiol 17-beta-dehydrogenase 8 1.1.1.62 0.862
1edo NAP3-oxoacyl-[acyl-carrier-protein] reductase 1, chloroplastic 1.1.1.100 0.854
4dc0 NDPPutative ketoacyl reductase 1.3.1 0.852
3bhi NAPCarbonyl reductase [NADPH] 1 1.1.1.184 0.851
4kwh NAPReductase homolog / 0.850
3qrw NDPPutative ketoacyl reductase 1.3.1 0.848
3vdq NAD3-hydroxybutyrate dehydrogenase / 0.847
1x7h NDPPutative ketoacyl reductase 1.3.1 0.846
3s55 NADPutative short-chain dehydrogenase/reductase / 0.846
2wsb NADGalactitol dehydrogenase / 0.844
5jla NADPutative short-chain dehydrogenase/reductase / 0.841
3pgx NADUncharacterized NAD-dependent oxidoreductase MAP_4146 / 0.831
3w8e NAD3-hydroxybutyrate dehydrogenase / 0.831
4dbz NDPPutative ketoacyl reductase 1.3.1 0.831
3geg NADShort-chain dehydrogenase/reductase SDR / 0.829
2gdz NAD15-hydroxyprostaglandin dehydrogenase [NAD(+)] 1.1.1.141 0.828
3wds NADNADH-dependent quinuclidinone reductase / 0.828
3sx2 NADUncharacterized protein / 0.825
3qwf NAP17beta-hydroxysteroid dehydrogenase / 0.821
3w8f NAD3-hydroxybutyrate dehydrogenase / 0.821
1cyd NDPCarbonyl reductase [NADPH] 2 1.1.1.184 0.820
4nbu NAI3-oxoacyl-(Acyl-carrier-protein) reductase / 0.820
1pr9 NAPL-xylulose reductase 1.1.1.10 0.819
2ztl NADD(-)-3-hydroxybutyrate dehydrogenase / 0.819
3tsc NADUncharacterized protein / 0.819
2bd0 NAPSepiapterin reductase / 0.818
3d3w NAPL-xylulose reductase 1.1.1.10 0.817
1nff NAD3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase 1.1.1.53 0.814
3o26 NDPSalutaridine reductase / 0.810
2jah NDPClavaldehyde dehydrogenase / 0.808
1oaa NAPSepiapterin reductase 1.1.1.153 0.807
3tn7 NJPShort-chain alcohol dehydrogenase / 0.807
1n5d NDPCarbonyl reductase [NADPH] 1 / 0.806
3ak4 NADNADH-dependent quinuclidinone reductase / 0.805
4is3 NAD3alpha-hydroxy bile acid-CoA-ester 3-dehydrogenase 2 1.17.98.1 0.805
1e3w NAD3-hydroxyacyl-CoA dehydrogenase type-2 1.1.1.35 0.804
4fj1 NAP17beta-hydroxysteroid dehydrogenase / 0.804
4hwk NAPSepiapterin reductase 1.1.1.153 0.801
4qec NAPElxO / 0.801
3l77 NJPShort-chain alcohol dehydrogenase / 0.796
3ndr NADPyridoxal 4-dehydrogenase 1.1.1.107 0.795
4fj0 NAP17beta-hydroxysteroid dehydrogenase / 0.794
2ag5 NAD3-hydroxybutyrate dehydrogenase type 2 / 0.793
3w8d NAD3-hydroxybutyrate dehydrogenase / 0.793
4dc1 NDPPutative ketoacyl reductase 1.3.1 0.790
3o4r NAPDehydrogenase/reductase SDR family member 4 1.1.1.184 0.789
3ruf NADUDP-N-acetylglucosamine 4-epimerase / 0.789
4b79 NADProbable short-chain dehydrogenase / 0.788
4rf2 NAPNADPH dependent R-specific alcohol dehydrogenase / 0.788
1kvr NADUDP-glucose 4-epimerase 5.1.3.2 0.787
3sju NDPKeto reductase / 0.787
1nfr NAD3-alpha-(or 20-beta)-hydroxysteroid dehydrogenase 1.1.1.53 0.784
1xg5 NAPDehydrogenase/reductase SDR family member 11 / 0.784
4nbt NAD3-oxoacyl-[acyl-carrier-protein] reductase / 0.784
2d1y NADOxidoreductase, short-chain dehydrogenase/reductase family / 0.779
4j7u NAPSepiapterin reductase 1.1.1.153 0.779
4o0l NDPNADPH-dependent 3-quinuclidinone reductase / 0.776
4c7k NAPCorticosteroid 11-beta-dehydrogenase isozyme 1 1.1.1.146 0.773
4j7x NAPSepiapterin reductase 1.1.1.153 0.772
3lu1 NADUDP-N-acetylglucosamine 4-epimerase / 0.771
4fj2 NAP17beta-hydroxysteroid dehydrogenase / 0.770
1iy8 NADLevodione reductase / 0.767
3rj5 NADAlcohol dehydrogenase 1.1.1.1 0.767
2q2q NADBeta-D-hydroxybutyrate dehydrogenase / 0.766
3r3s NADPutative oxidoreductase / 0.766
1e3s NAD3-hydroxyacyl-CoA dehydrogenase type-2 1.1.1.35 0.764
2o23 NAD3-hydroxyacyl-CoA dehydrogenase type-2 1.1.1.35 0.764
3rua NADUDP-N-acetylglucosamine 4-epimerase / 0.764
3ai3 NDPNADPH-sorbose reductase / 0.763
3iah NAPPutative oxoacyl-(Acyl carrier protein) reductase / 0.763
4qed NAPElxO / 0.763
5lc1 NADL-threonine 3-dehydrogenase / 0.763
3ru9 NADUDP-N-acetylglucosamine 4-epimerase / 0.762
4pvd NDPNADPH-dependent methylglyoxal reductase GRE2 / 0.761
5cpb NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.760
1bdb NADCis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase / 0.759
1zem NADXylitol dehydrogenase / 0.759
1e6w NAD3-hydroxyacyl-CoA dehydrogenase type-2 1.1.1.35 0.757
2zat NAPDehydrogenase/reductase SDR family member 4 1.1.1.184 0.757
1x7g NAPPutative ketoacyl reductase 1.3.1 0.756
1xse NDPCorticosteroid 11-beta-dehydrogenase isozyme 1 1.1.1.146 0.756
2rbe NDPCorticosteroid 11-beta-dehydrogenase isozyme 1 1.1.1.146 0.755
2p5y NADUDP-glucose 4-epimerase / 0.754
3ru7 NADUDP-N-acetylglucosamine 4-epimerase / 0.754
1rwb NADGlucose 1-dehydrogenase 1.1.1.47 0.752
2q2v NADBeta-D-hydroxybutyrate dehydrogenase / 0.752
2y99 NADCis-2,3-dihydrobiphenyl-2,3-diol dehydrogenase 1.3.1.56 0.752
5idw NAPShort-chain dehydrogenase/reductase SDR / 0.752
1gee NADGlucose 1-dehydrogenase 1.1.1.47 0.750
4bmv NAPShort-chain dehydrogenase / 0.750
1rkx NADCDP-D-glucose-4,6-dehydratase / 0.748
1i3l NADUDP-glucose 4-epimerase / 0.747
1ipe NDPTropinone reductase 2 1.1.1.236 0.747
1ae1 NAPTropinone reductase 1 / 0.746
1xkq NDPUncharacterized protein / 0.746
2yy7 NADL-threonine dehydrogenase / 0.746
2ztv NADD(-)-3-hydroxybutyrate dehydrogenase / 0.745
3rj9 NADAlcohol dehydrogenase 1.1.1.1 0.745
2p5u NADUDP-glucose 4-epimerase / 0.744
3ai2 NDPNADPH-sorbose reductase / 0.743
3a4v NADNDP-sugar epimerase / 0.741
3rku NAPNADP-dependent 3-hydroxy acid dehydrogenase / 0.740
4yac NAIC alpha-dehydrogenase / 0.740
1u7t TDT3-hydroxyacyl-CoA dehydrogenase type-2 1.1.1.35 0.739
2c29 NAPDihydroflavonol 4-reductase / 0.739
1g6k NADGlucose 1-dehydrogenase 1.1.1.47 0.738
1nai NADUDP-glucose 4-epimerase 5.1.3.2 0.738
3ruc NADUDP-N-acetylglucosamine 4-epimerase / 0.737
3wmx NADNAD dependent epimerase/dehydratase / 0.736
1gco NADGlucose 1-dehydrogenase 1.1.1.47 0.735
1mg5 NAIAlcohol dehydrogenase 1.1.1.1 0.735
2wdz NADGalactitol dehydrogenase / 0.735
3ruh NADUDP-N-acetylglucosamine 4-epimerase / 0.735
4zju NADEnoyl-[acyl-carrier-protein] reductase [NADH] / 0.732
3gy0 NAPNAD(P)-dependent oxidoreductase / 0.730
2b69 NADUDP-glucuronic acid decarboxylase 1 4.1.1.35 0.729
4twr NADNAD binding site:NAD-dependent epimerase/dehydratase:UDP-glucose 4-epimerase / 0.729
1sny NAPLD36273p / 0.727
4yai NAIC alpha-dehydrogenase / 0.727
1h5q NAPNADP-dependent mannitol dehydrogenase 1.1.1.138 0.726
1fdu NAPEstradiol 17-beta-dehydrogenase 1 1.1.1.62 0.725
3mje NDPAmphB / 0.724
3sj7 NDP3-oxoacyl-(Acyl-carrier-protein) reductase, putative / 0.724
2b4q NAPRhamnolipids biosynthesis 3-oxoacyl-[acyl-carrier-protein] reductase 1.1.1.100 0.723
2hrb NAPCarbonyl reductase [NADPH] 3 1.1.1.184 0.723
2dkn NAI3-alpha-hydroxysteroid dehydrogenase / 0.721
3h4v NAPPteridine reductase 1 1.5.1.33 0.721
4ej0 NAPADP-L-glycero-D-manno-heptose-6-epimerase / 0.721
2ztu NADD(-)-3-hydroxybutyrate dehydrogenase / 0.720
4bms NAPAlclohol dehydrogenase/short-chain dehydrogenase / 0.720
4dmm NAP3-oxoacyl-[acyl-carrier-protein] reductase / 0.719
4k6f NAPPutative Acetoacetyl-CoA reductase / 0.719
2x6t NAPADP-L-glycero-D-manno-heptose-6-epimerase / 0.718
1eny NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.717
2yut NAPPutative short-chain oxidoreductase / 0.716
3o03 NAPDehydrogenase with different specificities (Related to short-chain alcohol dehydrogenase) / 0.716
3p19 NDPPutative blue fluorescent protein / 0.716
4hxy NDPPlm1 / 0.715
4i5e NAPAlclohol dehydrogenase/short-chain dehydrogenase / 0.715
2nv6 ZIDEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.713
3icp NADNAD-dependent epimerase/dehydratase / 0.713
5bt9 NAP3-oxoacyl-(Acyl-carrier-protein) reductase / 0.713
2c54 NADGDP-mannose 3,5-epimerase 5.1.3.18 0.712
4hp8 NAP2-deoxy-D-gluconate 3-dehydrogenase / 0.709
1sby NADAlcohol dehydrogenase 1.1.1.1 0.708
3ajr NADNDP-sugar epimerase / 0.708
4iqg NAPShort-chain dehydrogenase/reductase SDR / 0.708
1b16 NAQAlcohol dehydrogenase 1.1.1.1 0.707
5jy1 NADPutative short-chain dehydrogenase/reductase / 0.707
3aw9 NADNAD-dependent epimerase/dehydratase / 0.706
4nbw NADShort-chain dehydrogenase/reductase SDR / 0.705
3of2 NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.704
4egb NADdTDP-glucose 4,6-dehydratase / 0.704
4lis NADUDP-glucose 4-epimerase (Eurofung) / 0.704
2x86 NAPADP-L-glycero-D-manno-heptose-6-epimerase / 0.703
3ko8 NADNAD-dependent epimerase/dehydratase / 0.703
1g1a NADdTDP-glucose 4,6-dehydratase / 0.702
2nnl NAPDihydroflavonol 4-reductase 1.1.1.219 0.702
2ntj P1HEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.702
1bxk NADdTDP-glucose 4,6-dehydratase 2 / 0.701
3uic NADEnoyl-[acyl-carrier-protein] reductase [NADH] / 0.701
2hun NAD336aa long hypothetical dTDP-glucose 4,6-dehydratase / 0.699
3oew NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.699
1orr NADCDP-paratose 2-epimerase / 0.698
1vl8 NAPOxidoreductase, short chain dehydrogenase/reductase family / 0.697
1w4z NAPPutative ketoacyl reductase 1.3.1 0.696
2pr2 DG1Enoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.696
3rud NADUDP-N-acetylglucosamine 4-epimerase / 0.696
3rue NADUDP-N-acetylglucosamine 4-epimerase / 0.696
4u7w NDPMxaA / 0.696
1w73 NAP2,4-dienoyl-CoA reductase, mitochondrial 1.3.1.34 0.695
2idz ZIDEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.694
3ehe NADUDP-glucose 4-epimerase (GalE-1) / 0.694
3a1n NADNDP-sugar epimerase / 0.693
3hwr NDP2-dehydropantoate 2-reductase / 0.692
1enz NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.690
2dte NAIGlucose 1-dehydrogenase related protein / 0.690
1eq2 NAPADP-L-glycero-D-manno-heptose-6-epimerase / 0.688
2bgm NAJSecoisolariciresinol dehydrogenase 1.1.1.331 0.687
2ggs NDPdTDP-4-dehydrorhamnose reductase / 0.687
2ydx NAPMethionine adenosyltransferase 2 subunit beta / 0.687
3lqf NADGalactitol dehydrogenase / 0.687
3oey NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.687
5b1y NDP3-oxoacyl-[acyl-carrier-protein] reductase / 0.686
1b15 NAEAlcohol dehydrogenase 1.1.1.1 0.685
1p44 NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.685
1i2b NADUDP-sulfoquinovose synthase, chloroplastic 3.13.1.1 0.684
2ntv P1HEnoyl-[acyl-carrier-protein] reductase [NADH] / 0.684
4fc7 NAPPeroxisomal 2,4-dienoyl-CoA reductase 1.3.1.34 0.684
1wnt NAPL-xylulose reductase 1.1.1.10 0.683
2eq7 NADDihydrolipoyl dehydrogenase / 0.683
4eso NAPPutative oxidoreductase / 0.683
4iv8 SAMPhosphoethanolamine N-methyltransferase,putative / 0.683
4m87 NADEnoyl-[acyl-carrier-protein] reductase [NADH] / 0.683
2ieb ZIDEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.681
1d2h SAHGlycine N-methyltransferase 2.1.1.20 0.680
1fk8 NAD3-alpha-hydroxysteroid dehydrogenase/carbonyl reductase 1.1.1.50 0.680
1u7t NAD3-hydroxyacyl-CoA dehydrogenase type-2 1.1.1.35 0.680
2ztm NADD(-)-3-hydroxybutyrate dehydrogenase / 0.680
4oxy NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.680
4yr9 NADL-threonine 3-dehydrogenase, mitochondrial 1.1.1.103 0.678
1ahh NAD7-alpha-hydroxysteroid dehydrogenase 1.1.1.159 0.677
4bqp NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.676
3uce NDPDehydrogenase / 0.675
4trn NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.675
1qyv NAPEstradiol 17-beta-dehydrogenase 1 1.1.1.62 0.674
2c7q SAHModification methylase HhaI 2.1.1.37 0.674
2wyv NADEnoyl-[acyl-carrier-protein] reductase [NADH] / 0.674
3ad9 FADSubunit beta of sarcosine oxidase / 0.674
5je3 SAHMethyl transferase / 0.674
3pef NAPGlyoxalate/3-oxopropanoate/4-oxobutanoate reductase / 0.673
3cn8 FADPolyamine oxidase FMS1 / 0.672
3hja NADGlyceraldehyde-3-phosphate dehydrogenase / 0.672
2b35 NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.671
2q7v FADThioredoxin reductase / 0.671
3tox NAPPutative oxidoreductase / 0.671
1b14 NADAlcohol dehydrogenase 1.1.1.1 0.670
1grg FADGlutathione reductase, mitochondrial 1.8.1.7 0.670
3mht SAHModification methylase HhaI 2.1.1.37 0.670
2ewm NAD(S)-1-Phenylethanol dehydrogenase 1.1.1.311 0.669
2i9p NAD3-hydroxyisobutyrate dehydrogenase, mitochondrial 1.1.1.31 0.668
3ssm SAHMycinamicin VI 2''-O-methyltransferase / 0.668
1ek5 NADUDP-glucose 4-epimerase / 0.667
1i9g SAMtRNA (adenine(58)-N(1))-methyltransferase TrmI / 0.667
1rpn NDPGDP-mannose 4,6-dehydratase / 0.667
3sxp NADADP-L-glycero-D-mannoheptose-6-epimerase / 0.666
1w8d NAP2,4-dienoyl-CoA reductase, mitochondrial 1.3.1.34 0.663
2b37 NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.662
3zhb NAPPutative dehydrogenase / 0.662
4dqu NAIEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.662
1kc1 NDPdTDP-4-dehydrorhamnose reductase 1.1.1.133 0.661
3bgv SAHmRNA cap guanine-N7 methyltransferase 2.1.1.56 0.661
3orf NADDihydropteridine reductase 1.5.1.34 0.661
3pdu NAPGlyoxalate/3-oxopropanoate/4-oxobutanoate reductase / 0.661
3bmo NAPPteridine reductase / 0.660
3nt2 NADInositol 2-dehydrogenase/D-chiro-inositol 3-dehydrogenase 1.1.1.18 0.660
3pvz NADUDP-N-acetylglucosamine 4,6-dehydratase / 0.660
4b69 FADL-ornithine N(5)-monooxygenase / 0.660
4guu FA9Lysine-specific histone demethylase 1B 1 0.659
4bii NADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.658
3l4s NADGlyceraldehyde-3-phosphate dehydrogenase 1 / 0.657
4dre NAIEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.657
2c59 NADGDP-mannose 3,5-epimerase 5.1.3.18 0.656
2dc1 NADProbable L-aspartate dehydrogenase / 0.656
1hdo NAPFlavin reductase (NADPH) / 0.655
1y56 ATPUncharacterized protein / 0.655
2gn8 NAPUDP-N-acetylglucosamine 4,6-dehydratase (inverting) 4.2.1.115 0.655
2np7 NEAModification methylase TaqI 2.1.1.72 0.655
3lzw FADFerredoxin--NADP reductase 2 1.18.1.2 0.655
3w6u NAP6-phosphogluconate dehydrogenase, NAD-binding protein / 0.655
4ek9 EP4Histone-lysine N-methyltransferase, H3 lysine-79 specific 2.1.1.43 0.655
4fw8 NAI3-oxoacyl-(Acyl-carrier-protein) reductase / 0.655
4txi FAD[F-actin]-methionine sulfoxide oxidase MICAL1 1.14.13 0.654
1nw6 SFGModification methylase RsrI 2.1.1.72 0.653
2bh2 SAH23S rRNA (uracil(1939)-C(5))-methyltransferase RlmD / 0.653
3a9w NADNDP-sugar epimerase / 0.653
4j2w FADKynurenine 3-monooxygenase / 0.653
4kvz SAHPtnL protein / 0.653
1nhs FADNADH peroxidase 1.11.1.1 0.652
2q1w NADPutative nucleotide sugar epimerase/ dehydratase / 0.652
3aut NAIGlucose 1-dehydrogenase 4 1.1.1.47 0.652
5jyd NADShort chain dehydrogenase / 0.652
1b2l NDCAlcohol dehydrogenase 1.1.1.1 0.651
2h9i EADEnoyl-[acyl-carrier-protein] reductase [NADH] 1.3.1.9 0.651
4l4x NDPAmphI / 0.651
3bgi SAHThiopurine S-methyltransferase 2.1.1.67 0.650
3v1y NADGlyceraldehyde-3-phosphate dehydrogenase 1, cytosolic 1.2.1.12 0.650
4idg NADPutative UDP-glucose 4-epimerase / 0.650