Binding Sites 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
Binding Sites are considered as similar when the similarity value is greater than 0.44
PDB ID | HET | Uniprot Name | EC Number |
---|---|---|---|
1kie | AD3 | IAG-nucleoside hydrolase |
PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
---|---|---|---|---|---|
1kie | AD3 | IAG-nucleoside hydrolase | / | 1.000 | |
3b9g | IMH | IAG-nucleoside hydrolase | / | 0.527 | |
3zpq | XF5 | Beta-1 adrenergic receptor | / | 0.490 | |
3zj6 | VM2 | Raucaffricine-O-beta-D-glucosidase | 3.2.1.125 | 0.488 | |
1xnz | FCD | Methionine aminopeptidase | / | 0.484 | |
3k45 | 51P | Dihydrofolate reductase | 1.5.1.3 | 0.483 | |
3l9m | L9M | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.482 | |
2j7c | IDE | Beta-glucosidase A | 3.2.1.21 | 0.480 | |
2x9v | TMQ | Pteridine reductase | / | 0.480 | |
1jdz | FMB | Purine nucleoside phosphorylase | / | 0.479 | |
2vrj | NCW | Beta-glucosidase A | 3.2.1.21 | 0.477 | |
3h4v | DVP | Pteridine reductase 1 | 1.5.1.33 | 0.477 | |
3l3l | L3L | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.476 | |
2y03 | 5FW | Beta-1 adrenergic receptor | / | 0.475 | |
3aiq | HBO | 4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl glucoside beta-D-glucosidase 1b, chloroplastic | 3.2.1.182 | 0.474 | |
3ug8 | IMN | Aldo-keto reductase family 1 member C3 | / | 0.474 | |
4i6h | 1C8 | Serine/threonine-protein kinase PLK2 | 2.7.11.21 | 0.474 | |
2vt4 | P32 | Beta-1 adrenergic receptor | / | 0.473 | |
1dr4 | HBI | Dihydrofolate reductase | 1.5.1.3 | 0.472 | |
1hfr | MOT | Dihydrofolate reductase | 1.5.1.3 | 0.472 | |
1rvv | INI | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.472 | |
4dya | 0MF | Nucleoprotein | / | 0.472 | |
2vbv | FMN | Riboflavin kinase | 2.7.1.161 | 0.471 | |
4bvn | P32 | Beta-1 adrenergic receptor | / | 0.471 | |
4dyp | 0MS | Nucleoprotein | / | 0.469 | |
4jpg | 1OX | Pyruvate kinase PKM | 2.7.1.40 | 0.469 | |
3f6s | FMN | Flavodoxin | / | 0.468 | |
4da6 | GA2 | Purine nucleoside phosphorylase DeoD-type | 2.4.2.1 | 0.468 | |
1v08 | NTZ | 4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl glucoside beta-D-glucosidase 1, chloroplastic | 3.2.1.182 | 0.467 | |
4k9y | K9Y | Focal adhesion kinase 1 | 2.7.10.2 | 0.467 | |
3c36 | KAI | Glutamate receptor ionotropic, kainate 1 | / | 0.466 | |
1p33 | MTX | Pteridine reductase 1 | 1.5.1.33 | 0.465 | |
3jqg | AX6 | Pteridine reductase, putative | / | 0.465 | |
3qdz | PRO_ALA_PRO_ARG | Prothrombin | 3.4.21.5 | 0.465 | |
3rl4 | 5GP | Metallophosphoesterase MPPED2 | 3.1 | 0.465 | |
5a4w | QCT | Glutathione S-transferase F2 | 2.5.1.18 | 0.465 | |
2ycx | P32 | Beta-1 adrenergic receptor | / | 0.465 | |
5d6l | CAU | Beta-2 adrenergic receptor | / | 0.465 | |
3aiv | HBO | 4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl glucoside beta-D-glucosidase, chloroplastic | 3.2.1.182 | 0.464 | |
3rhj | NAP | Cytosolic 10-formyltetrahydrofolate dehydrogenase | 1.5.1.6 | 0.464 | |
4b14 | 4XB | Glycylpeptide N-tetradecanoyltransferase | / | 0.464 | |
1e7w | MTX | Pteridine reductase 1 | 1.5.1.33 | 0.463 | |
3cas | ASD | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.463 | |
2bf7 | HBI | Pteridine reductase 1 | 1.5.1.33 | 0.462 | |
3bld | PRF | Queuine tRNA-ribosyltransferase | 2.4.2.29 | 0.462 | |
4aza | MGO | Eukaryotic translation initiation factor 4E | / | 0.462 | |
4xp4 | COC | Sodium-dependent dopamine transporter | / | 0.462 | |
4qij | 1HA | 1,4-dihydroxy-2-naphthoyl-CoA synthase | / | 0.461 | |
1maq | PGU | Aspartate aminotransferase, mitochondrial | 2.6.1.1 | 0.460 | |
1u1j | C2F | 5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase 1 | 2.1.1.14 | 0.460 | |
2c1z | KMP | Anthocyanidin 3-O-glucosyltransferase 2 | 2.4.1.115 | 0.460 | |
2fjm | 073 | Tyrosine-protein phosphatase non-receptor type 1 | 3.1.3.48 | 0.460 | |
4a95 | 9MT | Glycylpeptide N-tetradecanoyltransferase | / | 0.460 | |
4gv7 | MEW | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.460 | |
1i5r | HYC | Estradiol 17-beta-dehydrogenase 1 | 1.1.1.62 | 0.459 | |
2o8h | 227 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.459 | |
2v57 | PRL | TetR family transcriptional regulator | / | 0.459 | |
3c49 | KU8 | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 | 0.459 | |
3d3p | 20A | cAMP-specific 3',5'-cyclic phosphodiesterase 4B | 3.1.4.53 | 0.459 | |
4a2z | VIQ | Glycylpeptide N-tetradecanoyltransferase | / | 0.459 | |
4u16 | 3C0 | Muscarinic acetylcholine receptor M3 | / | 0.459 | |
1q0z | AKA | Aclacinomycin methylesterase RdmC | 3.1.1.95 | 0.458 | |
1xr2 | C2F | 5-methyltetrahydropteroyltriglutamate--homocysteine methyltransferase | 2.1.1.14 | 0.458 | |
2ouy | CMP | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.458 | |
2x2r | ADP | Kinesin-like protein KIF11 | / | 0.458 | |
3roe | THM | NAD(P)H-hydrate epimerase | 5.1.99.6 | 0.458 | |
1e66 | HUX | Acetylcholinesterase | 3.1.1.7 | 0.457 | |
1s7g | NAD | NAD-dependent protein deacylase 2 | / | 0.457 | |
2i4t | UA2 | Purine nucleoside phosphorylase, putative | / | 0.457 | |
2q94 | A04 | Methionine aminopeptidase | / | 0.457 | |
3cr7 | PPS | Adenylyl-sulfate kinase | 2.7.1.25 | 0.457 | |
3jq6 | DX1 | Pteridine reductase, putative | / | 0.457 | |
3jq7 | DX2 | Pteridine reductase, putative | / | 0.457 | |
4a3u | FMN | NADH:flavin oxidoreductase/NADH oxidase | / | 0.457 | |
4l6s | 1WQ | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.457 | |
1d3d | BZT | Prothrombin | 3.4.21.5 | 0.456 | |
1e92 | HBI | Pteridine reductase 1 | 1.5.1.33 | 0.456 | |
1pr4 | MTP | Purine nucleoside phosphorylase DeoD-type | / | 0.456 | |
3htj | ET | EbrA repressor | / | 0.456 | |
3rvi | RVI | Beta-secretase 1 | 3.4.23.46 | 0.456 | |
1mxf | MTX | Putative pteridine reductase 2 | / | 0.455 | |
2rku | R78 | Serine/threonine-protein kinase PLK1 | 2.7.11.21 | 0.455 | |
3occ | DIH | Purine nucleoside phosphorylase DeoD-type | / | 0.455 | |
1dlr | MXA | Dihydrofolate reductase | 1.5.1.3 | 0.454 | |
1q0r | AKT | Aclacinomycin methylesterase RdmC | 3.1.1.95 | 0.454 | |
1q63 | AIQ | Queuine tRNA-ribosyltransferase | 2.4.2.29 | 0.454 | |
1zis | INI | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.454 | |
2aou | CQA | Histamine N-methyltransferase | 2.1.1.8 | 0.454 | |
2bfm | TOP | Pteridine reductase 1 | 1.5.1.33 | 0.454 | |
2io6 | 330 | Wee1-like protein kinase | 2.7.10.2 | 0.454 | |
3hii | PNT | Amiloride-sensitive amine oxidase [copper-containing] | / | 0.454 | |
1e1f | PSG | 4-hydroxy-7-methoxy-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yl glucoside beta-D-glucosidase 1, chloroplastic | 3.2.1.182 | 0.453 | |
1hqt | NAP | Alcohol dehydrogenase [NADP(+)] | 1.1.1.2 | 0.453 | |
2ct8 | MSP | Methionine--tRNA ligase | 6.1.1.10 | 0.453 | |
2j7d | GI1 | Beta-glucosidase A | 3.2.1.21 | 0.453 | |
2xlt | NA0 | Putative flavin-containing monooxygenase | / | 0.453 | |
3biz | 61E | Wee1-like protein kinase | 2.7.10.2 | 0.453 | |
4amj | CVD | Beta-1 adrenergic receptor | / | 0.453 | |
4kq2 | U5P | Glycogen [starch] synthase isoform 2 | 2.4.1.11 | 0.453 | |
4kq6 | DLZ | 6,7-dimethyl-8-ribityllumazine synthase | / | 0.453 | |
3cqe | P91 | Wee1-like protein kinase | 2.7.10.2 | 0.452 | |
3l3r | OAG | Dihydrofolate reductase | 1.5.1.3 | 0.452 | |
4gh3 | 0EV | Queuine tRNA-ribosyltransferase | 2.4.2.29 | 0.452 | |
1y2b | DEE | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.451 | |
2xug | TZ4 | Acetylcholinesterase | 3.1.1.7 | 0.451 | |
3hth | PRL | EbrA repressor | / | 0.451 | |
3jq8 | DX3 | Pteridine reductase, putative | / | 0.451 | |
4a4o | 664 | Serine/threonine-protein kinase PLK1 | 2.7.11.21 | 0.451 | |
4b6l | 9ZP | Serine/threonine-protein kinase PLK3 | 2.7.11.21 | 0.451 | |
4nwi | CTN | 7-methylguanosine phosphate-specific 5'-nucleotidase | / | 0.451 | |
5bn4 | ANP | V-type ATP synthase alpha chain | / | 0.451 | |
1kic | NOS | IAG-nucleoside hydrolase | / | 0.450 | |
1pr6 | XYA | Purine nucleoside phosphorylase DeoD-type | / | 0.450 | |
2gqn | BLP | Cystathionine beta-lyase MetC | 4.4.1.8 | 0.450 | |
2w3m | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.450 | |
4a30 | QMI | Glycylpeptide N-tetradecanoyltransferase | / | 0.450 | |
4dan | 2FA | Purine nucleoside phosphorylase DeoD-type | 2.4.2.1 | 0.450 | |
2q96 | A18 | Methionine aminopeptidase | / | 0.449 | |
4feu | 537 | Aminoglycoside 3'-phosphotransferase AphA1-IAB | / | 0.449 | |
4n9q | FMN | FMN-dependent NADH-azoreductase 1 | / | 0.449 | |
2rh1 | CAU | Beta-2 adrenergic receptor | / | 0.449 | |
1d3p | BT3 | Prothrombin | 3.4.21.5 | 0.448 | |
1x8b | 824 | Wee1-like protein kinase | 2.7.10.2 | 0.448 | |
2g26 | 3LG | Renin | 3.4.23.15 | 0.448 | |
4eb5 | PLP | Cysteine desulfurase IscS 2 | / | 0.448 | |
4xoq | F42 | Coenzyme F420:L-glutamate ligase | / | 0.448 | |
1pke | 2FD | Purine nucleoside phosphorylase DeoD-type | / | 0.447 | |
1xmm | M7G | m7GpppX diphosphatase | 3.6.1.59 | 0.447 | |
2uuo | LK3 | UDP-N-acetylmuramoylalanine--D-glutamate ligase | 6.3.2.9 | 0.447 | |
2xlp | NAP | Putative flavin-containing monooxygenase | / | 0.447 | |
2z2w | 770 | Wee1-like protein kinase | 2.7.10.2 | 0.447 | |
3c35 | KAI | Glutamate receptor ionotropic, kainate 1 | / | 0.447 | |
3gyf | 51P | Dihydrofolate reductase | 1.5.1.3 | 0.447 | |
4b12 | C23 | Glycylpeptide N-tetradecanoyltransferase | / | 0.447 | |
5d5a | CAU | Beta-2 adrenergic receptor | / | 0.447 | |
1cq6 | PY4 | Aspartate aminotransferase | 2.6.1.1 | 0.446 | |
2vq7 | NAP | Putative flavin-containing monooxygenase | / | 0.446 | |
2vz0 | D64 | Pteridine reductase | / | 0.446 | |
2yac | 937 | Serine/threonine-protein kinase PLK1 | 2.7.11.21 | 0.446 | |
3ptq | NFG | Beta-glucosidase 12 | / | 0.446 | |
3rqw | ACH | Gamma-aminobutyric-acid receptor subunit beta-1 | / | 0.446 | |
3w5u | FAD | Ferredoxin | / | 0.446 | |
4ajf | F03 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.446 | |
4bjb | P34 | Tankyrase-2 | 2.4.2.30 | 0.446 | |
4fgc | PQ0 | NADPH-dependent 7-cyano-7-deazaguanine reductase | 1.7.1.13 | 0.446 | |
4i9z | 5BA | cGMP-specific 3',5'-cyclic phosphodiesterase | / | 0.446 | |
4m48 | 21B | Sodium-dependent dopamine transporter | / | 0.446 | |
4mmf | 29Q | Na(+):neurotransmitter symporter (Snf family) | / | 0.446 | |
1rxj | BNI | Streptavidin | / | 0.445 | |
1z71 | L17 | Prothrombin | 3.4.21.5 | 0.445 | |
2cle | F6F | Tryptophan synthase alpha chain | / | 0.445 | |
2fq6 | P3F | Cystathionine beta-lyase MetC | 4.4.1.8 | 0.445 | |
2puc | GUN | HTH-type transcriptional repressor PurR | / | 0.445 | |
2xk8 | 5R1 | Serine/threonine-protein kinase Nek2 | 2.7.11.1 | 0.445 | |
4au7 | SAH | Histone-lysine N-methyltransferase KMT5C | 2.1.1.43 | 0.445 | |
4c2p | X8Z | Angiotensin-converting enzyme | 3.2.1 | 0.445 | |
4dkb | DUN | Deoxyuridine triphosphatase, putative | / | 0.445 | |
2ycz | I32 | Beta-1 adrenergic receptor | / | 0.445 | |
4daj | 0HK | Muscarinic acetylcholine receptor M3 | / | 0.445 | |
2bfp | H4B | Pteridine reductase 1 | 1.5.1.33 | 0.444 | |
2evc | FC3 | Methionine aminopeptidase | / | 0.444 | |
2q92 | B23 | Methionine aminopeptidase | / | 0.444 | |
2wd8 | VGF | Pteridine reductase | / | 0.444 | |
2yhu | WHF | Pteridine reductase | / | 0.444 | |
3hf8 | ML0 | Tryptophan 5-hydroxylase 1 | 1.14.16.4 | 0.444 | |
3jx2 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.444 | |
3q2j | CKI | Aminoglycoside 3'-phosphotransferase | 2.7.1.95 | 0.444 | |
3qi4 | IBM | High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A | / | 0.444 | |
4f1m | ACP | Probable serine/threonine-protein kinase roco4 | 2.7.11.1 | 0.444 | |
4hsh | QEI | Queuine tRNA-ribosyltransferase | 2.4.2.29 | 0.444 | |
4m6k | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.444 | |
4u14 | 0HK | Muscarinic acetylcholine receptor M3 | / | 0.444 | |
1nqu | RDL | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.443 | |
1uxu | NAP | NAD(P)-dependent glyceraldehyde-3-phosphate dehydrogenase | / | 0.443 | |
1zyd | ATP | eIF-2-alpha kinase GCN2 | / | 0.443 | |
2gms | P0P | Putative pyridoxamine 5-phosphate-dependent dehydrase | / | 0.443 | |
2yne | YNE | Glycylpeptide N-tetradecanoyltransferase | / | 0.443 | |
3lcv | SAM | 16S rRNA (guanine(1405)-N(7))-methyltransferase | 2.1.1.179 | 0.443 | |
3n76 | CA2 | 3-dehydroquinate dehydratase | 4.2.1.10 | 0.443 | |
4b6s | 2HN | 3-dehydroquinate dehydratase | 4.2.1.10 | 0.443 | |
4da8 | BG2 | Purine nucleoside phosphorylase DeoD-type | 2.4.2.1 | 0.443 | |
4fps | 0UX | Queuine tRNA-ribosyltransferase | 2.4.2.29 | 0.443 | |
4itx | IN5 | Cystathionine beta-lyase MetC | 4.4.1.8 | 0.443 | |
5dsg | 0HK | Muscarinic acetylcholine receptor M4 | / | 0.443 | |
1q6n | P90 | Tyrosine-protein phosphatase non-receptor type 1 | 3.1.3.48 | 0.442 | |
2bd0 | BIO | Sepiapterin reductase | / | 0.442 | |
2fb8 | 215 | Serine/threonine-protein kinase B-raf | 2.7.11.1 | 0.442 | |
2fzj | DH3 | Dihydrofolate reductase | 1.5.1.3 | 0.442 | |
2in6 | 839 | Wee1-like protein kinase | 2.7.10.2 | 0.442 | |
2vi5 | Y19 | 6,7-dimethyl-8-ribityllumazine synthase | 2.5.1.78 | 0.442 | |
2xnp | WCX | Serine/threonine-protein kinase Nek2 | 2.7.11.1 | 0.442 | |
2z7g | EH9 | Adenosine deaminase | 3.5.4.4 | 0.442 | |
4azw | SAM | O-antigen chain terminator bifunctional methyltransferase/kinase WbdD | / | 0.442 | |
1j7l | ADP | Aminoglycoside 3'-phosphotransferase | 2.7.1.95 | 0.441 | |
1kmv | LII | Dihydrofolate reductase | 1.5.1.3 | 0.441 | |
1mkd | ZAR | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.441 | |
1om5 | H4B | Nitric oxide synthase, brain | 1.14.13.39 | 0.441 | |
2vqb | NAP | Putative flavin-containing monooxygenase | / | 0.441 | |
2vqs | BVD | Deoxynucleoside kinase | / | 0.441 | |
3ele | PLP | Aminotransferase | / | 0.441 | |
3n0y | APC | Adenylate cyclase 2 | / | 0.441 | |
4a86 | H35 | Major pollen allergen Bet v 1-A | / | 0.441 | |
5a8e | XTK | Beta-1 adrenergic receptor | / | 0.441 | |
2qjp | ANJ | Cytochrome b | / | 0.440 | |
2zi6 | 3D1 | Deoxycytidine kinase | 2.7.1.74 | 0.440 | |
3gc4 | AAQ | Queuine tRNA-ribosyltransferase | 2.4.2.29 | 0.440 | |
3gi2 | GHW | Dihydrofolate reductase | 1.5.1.3 | 0.440 | |
4keb | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.440 | |
4kfj | 1R0 | Dihydrofolate reductase | 1.5.1.3 | 0.440 | |
4rtb | SAM | Putative thiazole biosynthesis protein ThiH | / | 0.440 |