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 |
|---|---|---|---|
| 2itp | AEE | Epidermal growth factor receptor | 2.7.10.1 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 2itp | AEE | Epidermal growth factor receptor | 2.7.10.1 | 1.000 | |
| 2itt | AEE | Epidermal growth factor receptor | 2.7.10.1 | 0.589 | |
| 4jq8 | KJ8 | Epidermal growth factor receptor | 2.7.10.1 | 0.584 | |
| 1m17 | AQ4 | Epidermal growth factor receptor | 2.7.10.1 | 0.580 | |
| 2itx | ANP | Epidermal growth factor receptor | 2.7.10.1 | 0.577 | |
| 4jq7 | KJQ | Epidermal growth factor receptor | 2.7.10.1 | 0.577 | |
| 4jrv | KJV | Epidermal growth factor receptor | 2.7.10.1 | 0.571 | |
| 2itn | ANP | Epidermal growth factor receptor | 2.7.10.1 | 0.569 | |
| 2itw | ITQ | Epidermal growth factor receptor | 2.7.10.1 | 0.555 | |
| 4jr3 | KJR | Epidermal growth factor receptor | 2.7.10.1 | 0.544 | |
| 2itq | ITQ | Epidermal growth factor receptor | 2.7.10.1 | 0.532 | |
| 4wkq | IRE | Epidermal growth factor receptor | 2.7.10.1 | 0.518 | |
| 3w33 | W19 | Epidermal growth factor receptor | 2.7.10.1 | 0.509 | |
| 2dq7 | STU | Tyrosine-protein kinase Fyn | 2.7.10.2 | 0.508 | |
| 2ivu | ZD6 | Proto-oncogene tyrosine-protein kinase receptor Ret | 2.7.10.1 | 0.508 | |
| 3w2s | W2R | Epidermal growth factor receptor | 2.7.10.1 | 0.508 | |
| 4c02 | TAK | Activin receptor type-1 | 2.7.11.30 | 0.503 | |
| 2itv | ANP | Epidermal growth factor receptor | 2.7.10.1 | 0.500 | |
| 2bdf | 24A | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.498 | |
| 4mxx | DB8 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.496 | |
| 4riy | ADP | Epidermal growth factor receptor | 2.7.10.1 | 0.494 | |
| 4i23 | 1C9 | Epidermal growth factor receptor | 2.7.10.1 | 0.493 | |
| 3vjo | ANP | Epidermal growth factor receptor | 2.7.10.1 | 0.489 | |
| 1szm | BI4 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.488 | |
| 2itu | ITQ | Epidermal growth factor receptor | 2.7.10.1 | 0.488 | |
| 4bid | IE8 | Mitogen-activated protein kinase kinase kinase 5 | 2.7.11.25 | 0.484 | |
| 4hjo | AQ4 | Epidermal growth factor receptor | 2.7.10.1 | 0.484 | |
| 3a4o | STU | Tyrosine-protein kinase Lyn | 2.7.10.2 | 0.483 | |
| 4i22 | IRE | Epidermal growth factor receptor | 2.7.10.1 | 0.483 | |
| 1eh4 | IC1 | Casein kinase I homolog 1 | 2.7.11.1 | 0.482 | |
| 3cd3 | STU | Tyrosine-protein kinase Fes/Fps | 2.7.10.2 | 0.482 | |
| 1qpd | STU | Tyrosine-protein kinase Lck | 2.7.10.2 | 0.480 | |
| 1xkk | FMM | Epidermal growth factor receptor | 2.7.10.1 | 0.479 | |
| 4dgg | I76 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.479 | |
| 1nvq | UCN | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.478 | |
| 2of2 | 547 | Tyrosine-protein kinase Lck | 2.7.10.2 | 0.478 | |
| 3cbl | STU | Tyrosine-protein kinase Fes/Fps | 2.7.10.2 | 0.477 | |
| 1y57 | MPZ | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.476 | |
| 2y6o | 1N1 | Ephrin type-A receptor 4 | 2.7.10.1 | 0.476 | |
| 4ks8 | B49 | Serine/threonine-protein kinase PAK 6 | 2.7.11.1 | 0.475 | |
| 2eb3 | ANP | Epidermal growth factor receptor | 2.7.10.1 | 0.474 | |
| 1py5 | PY1 | TGF-beta receptor type-1 | 2.7.11.30 | 0.473 | |
| 4ft7 | H3K | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.473 | |
| 4mxo | DB8 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.472 | |
| 4dym | IYZ | Activin receptor type-1 | 2.7.11.30 | 0.470 | |
| 4gfg | 0XF | Tyrosine-protein kinase SYK | 2.7.10.2 | 0.470 | |
| 4l7s | G7K | Tyrosine-protein kinase ITK/TSK | 2.7.10.2 | 0.470 | |
| 3lcd | BDY | Macrophage colony-stimulating factor 1 receptor | 2.7.10.1 | 0.468 | |
| 4nks | 2M2 | Fibroblast growth factor receptor 1 | / | 0.468 | |
| 1byg | STU | Tyrosine-protein kinase CSK | / | 0.467 | |
| 1ywr | LI9 | Mitogen-activated protein kinase 14 | / | 0.467 | |
| 2ydj | YDJ | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.467 | |
| 4qmx | H8H | Serine/threonine-protein kinase 24 | 2.7.11.1 | 0.466 | |
| 3a62 | STU | Ribosomal protein S6 kinase beta-1 | 2.7.11.1 | 0.465 | |
| 3sd0 | TSK | Glycogen synthase kinase-3 beta | 2.7.11.26 | 0.465 | |
| 3vs6 | VSH | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.465 | |
| 5aac | VGH | ALK tyrosine kinase receptor | 2.7.10.1 | 0.465 | |
| 2itz | IRE | Epidermal growth factor receptor | 2.7.10.1 | 0.464 | |
| 4acc | 7YG | Glycogen synthase kinase-3 beta | 2.7.11.26 | 0.464 | |
| 3jxw | LXG | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.463 | |
| 3mtf | A3F | Activin receptor type-1 | 2.7.11.30 | 0.463 | |
| 4hvh | 19R | Tyrosine-protein kinase JAK3 | 2.7.10.2 | 0.462 | |
| 1vjy | 460 | TGF-beta receptor type-1 | 2.7.11.30 | 0.461 | |
| 3b8r | 887 | Vascular endothelial growth factor receptor 2 | 2.7.10.1 | 0.461 | |
| 2of4 | 979 | Tyrosine-protein kinase Lck | 2.7.10.2 | 0.460 | |
| 1qpj | STU | Tyrosine-protein kinase Lck | 2.7.10.2 | 0.459 | |
| 2j0k | 4ST | Focal adhesion kinase 1 | 2.7.10.2 | 0.459 | |
| 2j7t | 274 | Serine/threonine-protein kinase 10 | 2.7.11.1 | 0.459 | |
| 4dfn | 0K1 | Tyrosine-protein kinase SYK | 2.7.10.2 | 0.459 | |
| 4gk3 | L87 | Ephrin type-A receptor 3 | 2.7.10.1 | 0.459 | |
| 2h8h | H8H | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.458 | |
| 3v8w | 0G2 | Tyrosine-protein kinase ITK/TSK | 2.7.10.2 | 0.458 | |
| 3vs7 | KS1 | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.458 | |
| 4qna | X11 | Serine/threonine-protein kinase 24 | 2.7.11.1 | 0.458 | |
| 3qlg | 1N1 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.456 | |
| 4y95 | 746 | Tyrosine-protein kinase | / | 0.456 | |
| 4yzc | STU | Serine/threonine-protein kinase/endoribonuclease IRE1 | 2.7.11.1 | 0.456 | |
| 2zv9 | PP2 | Tyrosine-protein kinase Lyn | 2.7.10.2 | 0.454 | |
| 3zrk | ZRK | Glycogen synthase kinase-3 beta | 2.7.11.26 | 0.454 | |
| 1nvr | STU | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.453 | |
| 2bdj | HET | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.453 | |
| 2i0e | PDS | Protein kinase C beta type | 2.7.11.13 | 0.453 | |
| 2r7b | 253 | 3-phosphoinositide-dependent protein kinase 1 | 2.7.11.1 | 0.453 | |
| 3umx | Q18 | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.453 | |
| 3vjn | ANP | Epidermal growth factor receptor | 2.7.10.1 | 0.453 | |
| 3vrz | VRZ | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.453 | |
| 4bf2 | STU | Mitogen-activated protein kinase kinase kinase 5 | 2.7.11.25 | 0.453 | |
| 4j97 | ACP | Fibroblast growth factor receptor 2 | / | 0.453 | |
| 1yi3 | LY2 | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.452 | |
| 2zm1 | KSF | Tyrosine-protein kinase Lck | 2.7.10.2 | 0.452 | |
| 3fkl | FKL | Mitogen-activated protein kinase 14 | / | 0.452 | |
| 3zew | STU | Ephrin type-B receptor 4 | 2.7.10.1 | 0.452 | |
| 4aoj | V4Z | High affinity nerve growth factor receptor | 2.7.10.1 | 0.452 | |
| 4fob | 0US | ALK tyrosine kinase receptor | 2.7.10.1 | 0.452 | |
| 4y93 | 746 | Tyrosine-protein kinase | / | 0.452 | |
| 3hmm | 855 | TGF-beta receptor type-1 | 2.7.11.30 | 0.451 | |
| 3zh8 | C58 | Protein kinase C iota type | 2.7.11.13 | 0.451 | |
| 4b7t | CWT | Glycogen synthase kinase-3 beta | 2.7.11.26 | 0.451 | |
| 4grb | 0XG | Casein kinase II subunit alpha | 2.7.11.1 | 0.451 | |
| 4hvg | 19Q | Tyrosine-protein kinase JAK3 | 2.7.10.2 | 0.451 | |
| 4hyi | 1AO | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.451 | |
| 2hxl | 422 | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.450 | |
| 2ijm | ADP | Focal adhesion kinase 1 | 2.7.10.2 | 0.450 | |
| 3dt1 | P40 | Mitogen-activated protein kinase 14 | / | 0.449 | |
| 3sc1 | 3S1 | 3-phosphoinositide-dependent protein kinase 1 | 2.7.11.1 | 0.449 | |
| 4bdg | P3J | Serine/threonine-protein kinase Chk2 | 2.7.11.1 | 0.449 | |
| 4gk2 | L66 | Ephrin type-A receptor 3 | 2.7.10.1 | 0.449 | |
| 4xli | 1N1 | Abelson tyrosine-protein kinase 2 | 2.7.10.2 | 0.449 | |
| 5amn | DTQ | Proto-oncogene tyrosine-protein kinase receptor Ret | 2.7.10.1 | 0.449 | |
| 5ar4 | SB2 | Receptor-interacting serine/threonine-protein kinase 2 | 2.7.11.1 | 0.449 | |
| 2brn | DF1 | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.448 | |
| 3uic | NAD | Enoyl-[acyl-carrier-protein] reductase [NADH] | / | 0.448 | |
| 4bdf | H3R | Serine/threonine-protein kinase Chk2 | 2.7.11.1 | 0.448 | |
| 4c62 | XWW | Tyrosine-protein kinase JAK2 | / | 0.448 | |
| 4f63 | 0S7 | Fibroblast growth factor receptor 1 | / | 0.448 | |
| 4ien | COA | Putative acyl-CoA hydrolase | / | 0.448 | |
| 1kbo | FAD | NAD(P)H dehydrogenase [quinone] 1 | 1.6.5.2 | 0.447 | |
| 1snu | STU | Tyrosine-protein kinase ITK/TSK | 2.7.10.2 | 0.447 | |
| 2qo9 | ANP | Ephrin type-A receptor 3 | 2.7.10.1 | 0.447 | |
| 4iwo | 1H4 | Serine/threonine-protein kinase TBK1 | 2.7.11.1 | 0.447 | |
| 4iwq | 1FV | Serine/threonine-protein kinase TBK1 | 2.7.11.1 | 0.447 | |
| 4kbk | 1QG | Casein kinase I isoform delta | 2.7.11.1 | 0.447 | |
| 1u59 | STU | Tyrosine-protein kinase ZAP-70 | 2.7.10.2 | 0.446 | |
| 2xyu | Q9G | Ephrin type-A receptor 4 | 2.7.10.1 | 0.446 | |
| 3gob | HXX | DdmC | / | 0.446 | |
| 3w32 | W32 | Epidermal growth factor receptor | 2.7.10.1 | 0.446 | |
| 4nka | 2K7 | Fibroblast growth factor receptor 1 | / | 0.446 | |
| 4qmn | DB8 | Serine/threonine-protein kinase 24 | 2.7.11.1 | 0.446 | |
| 1ay0 | TPP | Transketolase 1 | 2.2.1.1 | 0.445 | |
| 1yol | S03 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.445 | |
| 2br1 | PFP | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.445 | |
| 2vwu | 7X1 | Ephrin type-B receptor 4 | 2.7.10.1 | 0.445 | |
| 1stc | STU | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.444 | |
| 1u54 | ACP | Activated CDC42 kinase 1 | / | 0.444 | |
| 2pwl | ACP | Fibroblast growth factor receptor 2 | / | 0.444 | |
| 3a99 | ANP | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.444 | |
| 3js2 | VM1 | Fibroblast growth factor receptor 1 | / | 0.444 | |
| 4aa5 | NQB | Mitogen-activated protein kinase 14 | / | 0.444 | |
| 4k11 | 0J9 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.444 | |
| 5a4k | FAD | NAD(P)H dehydrogenase [quinone] 1 | 1.6.5.2 | 0.444 | |
| 1xl2 | 189 | Gag-Pol polyprotein | 3.4.23.16 | 0.443 | |
| 2wmu | ZYU | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.443 | |
| 2wou | ZZF | TGF-beta receptor type-1 | 2.7.11.30 | 0.443 | |
| 2xvd | AS6 | Ephrin type-B receptor 4 | 2.7.10.1 | 0.443 | |
| 3u9n | 09H | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.443 | |
| 4fnz | NZF | ALK tyrosine kinase receptor | 2.7.10.1 | 0.443 | |
| 4lmu | QUE | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.443 | |
| 4qmt | H1N | Serine/threonine-protein kinase 24 | 2.7.11.1 | 0.443 | |
| 5aaa | VGH | ALK tyrosine kinase receptor | 2.7.10.1 | 0.443 | |
| 2hog | 710 | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.442 | |
| 2wmq | ZYQ | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.442 | |
| 3ac3 | KSH | Tyrosine-protein kinase Lck | 2.7.10.2 | 0.442 | |
| 3bgq | VX2 | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.442 | |
| 3flw | FLW | Mitogen-activated protein kinase 14 | / | 0.442 | |
| 3poz | 03P | Epidermal growth factor receptor | 2.7.10.1 | 0.442 | |
| 3q3b | 55E | Glycogen synthase kinase-3 beta | 2.7.11.26 | 0.442 | |
| 3sp9 | IL2 | Peroxisome proliferator-activated receptor delta | / | 0.442 | |
| 3uyt | 0CK | Casein kinase I isoform delta | 2.7.11.1 | 0.442 | |
| 1okz | UCN | 3-phosphoinositide-dependent protein kinase 1 | 2.7.11.1 | 0.441 | |
| 2brg | DFY | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.441 | |
| 2e9u | A25 | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.441 | |
| 3emg | 685 | Tyrosine-protein kinase SYK | 2.7.10.2 | 0.441 | |
| 3uvq | FS8 | Mitogen-activated protein kinase 14 | / | 0.441 | |
| 4j98 | ACP | Fibroblast growth factor receptor 2 | / | 0.441 | |
| 4xey | 1N1 | Tyrosine-protein kinase ABL1 | 2.7.10.2 | 0.441 | |
| 5ajq | DB8 | Serine/threonine-protein kinase 10 | 2.7.11.1 | 0.441 | |
| 1yi4 | ADN | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.440 | |
| 2e9o | A58 | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.440 | |
| 2gcd | STU | Serine/threonine-protein kinase TAO2 | 2.7.11.1 | 0.440 |