Cavities 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
PDB ID | HET | Uniprot Name | EC Number |
---|---|---|---|
1c72 | EPY | Glutathione S-transferase 2 | 2.5.1.18 |
PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
---|---|---|---|---|---|
1c72 | EPY | Glutathione S-transferase 2 | 2.5.1.18 | 1.000 | |
1gsu | GTX | Glutathione S-transferase 2 | 2.5.1.18 | 0.624 | |
5fwg | GPR | Glutathione S-transferase Mu 1 | 2.5.1.18 | 0.624 | |
4gst | GTD | Glutathione S-transferase Mu 1 | 2.5.1.18 | 0.617 | |
2gst | GPS | Glutathione S-transferase Mu 1 | 2.5.1.18 | 0.596 | |
6gsw | GPS | Glutathione S-transferase Mu 1 | 2.5.1.18 | 0.585 | |
3gst | GPR | Glutathione S-transferase Mu 1 | 2.5.1.18 | 0.581 | |
2uw0 | GVK | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.477 | |
1zar | ADP | RIO-type serine/threonine-protein kinase Rio2 | 2.7.11.1 | 0.472 | |
2gr1 | FAD | Ferredoxin reductase | / | 0.468 | |
4n3e | 2AN | Phenolic oxidative coupling protein | / | 0.466 | |
2uzu | L20 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.465 | |
3dnd | LL2 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.465 | |
4h4x | FAD | Biphenyl dioxygenase ferredoxin reductase subunit | / | 0.464 | |
1wvx | BD4 | Death-associated protein kinase 1 | 2.7.11.1 | 0.462 | |
4fti | H7K | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.462 | |
2jds | L20 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.460 | |
1fvv | 107 | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.458 | |
2izr | BRK | Casein kinase I isoform gamma-3 | 2.7.11.1 | 0.458 | |
4ks8 | B49 | Serine/threonine-protein kinase PAK 6 | 2.7.11.1 | 0.458 | |
5dpv | SKE | Aurora kinase A | 2.7.11.1 | 0.457 | |
4ezj | 0SC | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.456 | |
3nux | 3NV | Cyclin-dependent kinase 6 | 2.7.11.22 | 0.455 | |
3oog | YTP | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.454 | |
4anu | EM7 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.454 | |
4mk0 | 29X | Beta-adrenergic receptor kinase 1 | 2.7.11.15 | 0.451 | |
2a5u | QYT | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.450 | |
2uw7 | GVP | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.450 | |
3ezr | EZR | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.450 | |
3v04 | V04 | Dual specificity mitogen-activated protein kinase kinase 1 | 2.7.12.2 | 0.450 | |
1me7 | RVP | Inosine-5'-monophosphate dehydrogenase | / | 0.449 | |
3agl | A03 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.449 | |
3zew | STU | Ephrin type-B receptor 4 | 2.7.10.1 | 0.449 | |
4ezk | 0SD | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.449 | |
1kvo | OAP | Phospholipase A2, membrane associated | / | 0.448 | |
1tj2 | FAD | Bifunctional protein PutA | 1.5.5.2 | 0.448 | |
1yvj | 4ST | Tyrosine-protein kinase JAK3 | 2.7.10.2 | 0.448 | |
3at4 | CCK | Casein kinase II subunit alpha | 2.7.11.1 | 0.448 | |
4g17 | 0VN | Casein kinase I isoform gamma-3 | 2.7.11.1 | 0.448 | |
4h50 | NAP | Biphenyl dioxygenase ferredoxin reductase subunit | / | 0.448 | |
1kij | NOV | DNA gyrase subunit B | / | 0.447 | |
1n07 | FMN | Riboflavin kinase | 2.7.1.26 | 0.447 | |
1uad | GNP | Ras-related protein Ral-A | / | 0.447 | |
2cke | IQU | Death-associated protein kinase 2 | / | 0.447 | |
2vu3 | LZE | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.447 | |
4gt3 | ATP | Mitogen-activated protein kinase 1 | 2.7.11.24 | 0.447 | |
1ijj | LAR | Actin, alpha skeletal muscle | / | 0.446 | |
1jf7 | TBH | Tyrosine-protein phosphatase non-receptor type 1 | 3.1.3.48 | 0.446 | |
2uzv | SS5 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.446 | |
3au8 | NDP | 1-deoxy-D-xylulose 5-phosphate reductoisomerase, apicoplastic | 1.1.1.267 | 0.446 | |
1q8u | H52 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.445 | |
2uzt | SS3 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.444 | |
3qp0 | NI8 | Gag-Pol polyprotein | 3.4.23.16 | 0.444 | |
3upj | U03 | Gag-Pol polyprotein | / | 0.444 | |
3zo4 | QWI | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.444 | |
4bib | IEO | Mitogen-activated protein kinase kinase kinase 5 | 2.7.11.25 | 0.444 | |
4dta | ADN | APH(2'')-Id | / | 0.444 | |
4flh | 14K | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.444 | |
1q5k | TMU | Glycogen synthase kinase-3 beta | 2.7.11.26 | 0.443 | |
2vo3 | M04 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.443 | |
2w7x | D1A | Serine/threonine-protein kinase Chk2 | 2.7.11.1 | 0.443 | |
3rga | LSB | Epoxide hydrolase LasB | 5.5.1 | 0.443 | |
3sjh | LAR | Actin, alpha skeletal muscle | / | 0.443 | |
4bdg | P3J | Serine/threonine-protein kinase Chk2 | 2.7.11.1 | 0.443 | |
4dk5 | 0KO | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.443 | |
4fsr | HKC | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.443 | |
1q8t | Y27 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.442 | |
4a6c | QG9 | Gag-Pol polyprotein | 3.4.23.16 | 0.442 | |
4iwq | 1FV | Serine/threonine-protein kinase TBK1 | 2.7.11.1 | 0.442 | |
1wvy | STU | Death-associated protein kinase 1 | 2.7.11.1 | 0.441 | |
2ijm | ADP | Focal adhesion kinase 1 | 2.7.10.2 | 0.441 | |
2pe1 | 517 | 3-phosphoinositide-dependent protein kinase 1 | 2.7.11.1 | 0.441 | |
3sfu | RBV | Polyprotein | / | 0.441 | |
4px9 | ADP | ATP-dependent RNA helicase DDX3X | 3.6.4.13 | 0.441 | |
4upj | U04 | Gag-Pol polyprotein | / | 0.441 | |
5auz | GEN | Death-associated protein kinase 1 | 2.7.11.1 | 0.441 | |
1gij | 2PU | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.440 | |
1tu8 | GTX | Glutathione S-transferase 2 | 2.5.1.18 | 0.440 | |
1v59 | FAD | Dihydrolipoyl dehydrogenase, mitochondrial | 1.8.1.4 | 0.440 | |
2c1a | I5S | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.440 | |
2gu8 | 796 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.440 | |
3kdd | JZQ | Gag-Pol polyprotein | 3.4.23.16 | 0.440 | |
4fad | 0TB | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.440 | |
4iwy | ADP | Ribosomal protein S6--L-glutamate ligase | / | 0.440 | |
4jrn | ANP | Rhoptry kinase family protein | / | 0.440 | |
4l7f | 1V5 | Mitogen-activated protein kinase 8 | 2.7.11.24 | 0.440 |