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 |
---|---|---|---|
3c4h | DRL | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 |
PDB ID | HET | Uniprot Name | EC Number | Binding Site Similarity |
Align |
---|---|---|---|---|---|
3c4h | DRL | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 | 1.000 | |
3c49 | KU8 | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 | 0.775 | |
4gv2 | 5ME | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 | 0.698 | |
3ce0 | P34 | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 | 0.652 | |
4gv0 | 8ME | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 | 0.651 | |
4gv4 | MEJ | Poly [ADP-ribose] polymerase 3 | 2.4.2.30 | 0.633 | |
3gn7 | 3GN | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.591 | |
3l3l | L3L | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.583 | |
4hhy | 15R | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.581 | |
2rd6 | 78P | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.579 | |
3gjw | GJW | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.577 | |
1pax | DHQ | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.576 | |
1uk0 | FRM | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.574 | |
4tvj | 09L | Poly [ADP-ribose] polymerase 2 | 2.4.2.30 | 0.574 | |
1efy | BZC | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.559 | |
3l3m | A92 | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.554 | |
5ds3 | 09L | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.547 | |
4r5w | XAV | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.539 | |
4l6s | 1WQ | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.537 | |
2rcw | AAI | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.535 | |
4tjy | 3GN | Tankyrase-2 | 2.4.2.30 | 0.532 | |
5dsy | UHB | Poly [ADP-ribose] polymerase 2 | 2.4.2.30 | 0.518 | |
4bj9 | UHB | Tankyrase-2 | 2.4.2.30 | 0.510 | |
1xk9 | P34 | Exotoxin A | 2.4.2.36 | 0.503 | |
2zit | NAD | Exotoxin A | 2.4.2.36 | 0.502 | |
4pnm | NU1 | Tankyrase-2 | 2.4.2.30 | 0.501 | |
3b82 | NAD | Exotoxin A | 2.4.2.36 | 0.497 | |
1uk1 | FRQ | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.496 | |
4bjb | P34 | Tankyrase-2 | 2.4.2.30 | 0.492 | |
4gv7 | MEW | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.491 | |
4bjc | RPB | Tankyrase-2 | 2.4.2.30 | 0.484 | |
3gey | P34 | Poly [ADP-ribose] polymerase 15 | 2.4.2.30 | 0.482 | |
3b8h | NAD | Exotoxin A | 2.4.2.36 | 0.479 | |
3zky | WT4 | Isopenicillin N synthase | 1.21.3.1 | 0.475 | |
2yne | YNE | Glycylpeptide N-tetradecanoyltransferase | / | 0.471 | |
4b64 | NAP | L-ornithine N(5)-monooxygenase | / | 0.468 | |
3b78 | NAD | Exotoxin A | 2.4.2.36 | 0.467 | |
4hhz | 15S | Poly [ADP-ribose] polymerase 1 | 2.4.2.30 | 0.467 | |
1ddt | APU | Diphtheria toxin | / | 0.463 | |
2ejz | SAH | Diphthine synthase | / | 0.463 | |
4b13 | X25 | Glycylpeptide N-tetradecanoyltransferase | / | 0.463 | |
4krs | 1SX | Tankyrase-1 | 2.4.2.30 | 0.463 | |
1fap | RAP | Peptidyl-prolyl cis-trans isomerase FKBP1A | 5.2.1.8 | 0.461 | |
1fap | RAP | Serine/threonine-protein kinase mTOR | 2.7.11.1 | 0.461 | |
2fm5 | M99 | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.461 | |
1zm4 | TAD | Exotoxin A | 2.4.2.36 | 0.460 | |
2g8y | NAD | Hydroxycarboxylate dehydrogenase B | / | 0.459 | |
1i5r | HYC | Estradiol 17-beta-dehydrogenase 1 | 1.1.1.62 | 0.456 | |
3q9o | NAD | Cholix toxin | 2.4.2.36 | 0.456 | |
4b14 | 4XB | Glycylpeptide N-tetradecanoyltransferase | / | 0.456 | |
1rxj | BNI | Streptavidin | / | 0.455 | |
4ey7 | E20 | Acetylcholinesterase | 3.1.1.7 | 0.455 | |
1esm | COA | Pantothenate kinase | 2.7.1.33 | 0.452 | |
2cek | N8T | Acetylcholinesterase | 3.1.1.7 | 0.452 | |
4c2z | 646 | Glycylpeptide N-tetradecanoyltransferase 1 | / | 0.452 | |
1ry0 | PG2 | Aldo-keto reductase family 1 member C3 | / | 0.451 | |
1dtp | APU | Diphtheria toxin | / | 0.450 | |
1xf0 | ASD | Aldo-keto reductase family 1 member C3 | / | 0.450 | |
2jl1 | NAP | Triphenylmethane reductase | / | 0.450 | |
3u9y | 09L | Tankyrase-2 | 2.4.2.30 | 0.450 | |
1p0p | BCH | Cholinesterase | 3.1.1.8 | 0.447 | |
3k1w | BFX | Renin | 3.4.23.15 | 0.447 | |
3ug8 | IMN | Aldo-keto reductase family 1 member C3 | / | 0.447 | |
4u16 | 3C0 | Muscarinic acetylcholine receptor M3 | / | 0.447 | |
1odc | A8B | Acetylcholinesterase | 3.1.1.7 | 0.446 | |
1qjf | ACS | Isopenicillin N synthase | 1.21.3.1 | 0.446 | |
3jsx | CC2 | NAD(P)H dehydrogenase [quinone] 1 | 1.6.5.2 | 0.446 | |
4f0e | 0RU | Poly [ADP-ribose] polymerase 15 | 2.4.2.30 | 0.446 | |
4pnr | G18 | Tankyrase-2 | 2.4.2.30 | 0.446 | |
1tco | FK5 | Peptidyl-prolyl cis-trans isomerase FKBP1A | 5.2.1.8 | 0.445 | |
1tco | FK5 | Serine/threonine-protein phosphatase 2B catalytic subunit alpha isoform | 3.1.3.16 | 0.445 | |
2fap | RAD | Peptidyl-prolyl cis-trans isomerase FKBP1A | 5.2.1.8 | 0.445 | |
2fap | RAD | Serine/threonine-protein kinase mTOR | 2.7.11.1 | 0.445 | |
1ry8 | RUT | Aldo-keto reductase family 1 member C3 | / | 0.444 | |
2bf4 | FAD | NADPH--cytochrome P450 reductase | / | 0.444 | |
2hxz | H7J | Cathepsin S | 3.4.22.27 | 0.444 | |
2vf3 | GVS | 4-diphosphocytidyl-2-C-methyl-D-erythritol kinase | / | 0.444 | |
2x0f | TRH | WsaF | / | 0.444 | |
4fcb | 0T7 | cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A | 3.1.4.17 | 0.444 | |
4kp6 | 1S1 | cAMP-specific 3',5'-cyclic phosphodiesterase 4B | 3.1.4.53 | 0.444 | |
4li8 | 1XQ | Tankyrase-1 | 2.4.2.30 | 0.444 | |
1mkd | ZAR | cAMP-specific 3',5'-cyclic phosphodiesterase 4D | 3.1.4.53 | 0.443 | |
4bbh | YBN | Glycylpeptide N-tetradecanoyltransferase | / | 0.443 | |
4bft | ZVT | Pantothenate kinase | 2.7.1.33 | 0.443 | |
2iej | S48 | Protein farnesyltransferase subunit beta | 2.5.1.58 | 0.442 | |
4b65 | NDP | L-ornithine N(5)-monooxygenase | / | 0.442 | |
1yci | NDF | Hypoxia-inducible factor 1-alpha inhibitor | 1.14.11.30 | 0.441 | |
2vcm | M11 | Isopenicillin N synthase | 1.21.3.1 | 0.441 | |
2zev | IPE | Geranylgeranyl pyrophosphate synthase | / | 0.441 | |
4bfx | ZVX | Pantothenate kinase | 2.7.1.33 | 0.441 | |
4drj | RAP | Serine/threonine-protein kinase mTOR | 2.7.11.1 | 0.441 | |
4drj | RAP | Peptidyl-prolyl cis-trans isomerase FKBP4 | 5.2.1.8 | 0.441 | |
4jpg | 1OX | Pyruvate kinase PKM | 2.7.1.40 | 0.441 | |
4y1b | NAP | AntE | / | 0.441 | |
1oc1 | ASV | Isopenicillin N synthase | 1.21.3.1 | 0.440 | |
3q9b | B3N | Acetylpolyamine amidohydrolase | / | 0.440 | |
3u5y | SCG | Raucaffricine-O-beta-D-glucosidase | 3.2.1.125 | 0.440 | |
4j3m | AJ8 | Tankyrase-2 | 2.4.2.30 | 0.440 |