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 |
|---|---|---|---|
| 1ove | 358 | Mitogen-activated protein kinase 14 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 1ove | 358 | Mitogen-activated protein kinase 14 | / | 1.000 | |
| 3gc7 | B45 | Mitogen-activated protein kinase 14 | / | 0.589 | |
| 3zsh | 469 | Mitogen-activated protein kinase 14 | / | 0.581 | |
| 3fl4 | FL4 | Mitogen-activated protein kinase 14 | / | 0.577 | |
| 3fko | FKO | Mitogen-activated protein kinase 14 | / | 0.563 | |
| 3hub | 469 | Mitogen-activated protein kinase 14 | / | 0.561 | |
| 3fkn | FKN | Mitogen-activated protein kinase 14 | / | 0.559 | |
| 1ouy | 094 | Mitogen-activated protein kinase 14 | / | 0.540 | |
| 3gc9 | B45 | Mitogen-activated protein kinase 11 | 2.7.11.24 | 0.533 | |
| 1zzl | TZY | Mitogen-activated protein kinase 14 | / | 0.527 | |
| 1m7q | DQO | Mitogen-activated protein kinase 14 | / | 0.525 | |
| 2gfs | PQB | Mitogen-activated protein kinase 14 | / | 0.521 | |
| 1ouk | 084 | Mitogen-activated protein kinase 14 | / | 0.520 | |
| 3itz | P66 | Mitogen-activated protein kinase 14 | / | 0.517 | |
| 3fc1 | 52P | Mitogen-activated protein kinase 14 | / | 0.516 | |
| 3ds6 | A17 | Mitogen-activated protein kinase 14 | / | 0.514 | |
| 2yix | YIX | Mitogen-activated protein kinase 14 | / | 0.504 | |
| 3fmm | XI2 | Mitogen-activated protein kinase 14 | / | 0.498 | |
| 1zyj | BI5 | Mitogen-activated protein kinase 14 | / | 0.497 | |
| 3kf7 | L9G | Mitogen-activated protein kinase 14 | / | 0.497 | |
| 3fls | FLS | Mitogen-activated protein kinase 14 | / | 0.493 | |
| 3s4q | NK0 | Mitogen-activated protein kinase 14 | / | 0.491 | |
| 3mvl | 38P | Mitogen-activated protein kinase 14 | / | 0.490 | |
| 1w7h | 3IP | Mitogen-activated protein kinase 14 | / | 0.487 | |
| 3uvq | FS8 | Mitogen-activated protein kinase 14 | / | 0.487 | |
| 3flq | 891 | Mitogen-activated protein kinase 14 | / | 0.486 | |
| 3hll | I45 | Mitogen-activated protein kinase 14 | / | 0.484 | |
| 3hp5 | 52P | Mitogen-activated protein kinase 14 | / | 0.482 | |
| 1ywr | LI9 | Mitogen-activated protein kinase 14 | / | 0.481 | |
| 3roc | 29A | Mitogen-activated protein kinase 14 | / | 0.481 | |
| 3e92 | G6A | Mitogen-activated protein kinase 14 | / | 0.479 | |
| 3w33 | W19 | Epidermal growth factor receptor | 2.7.10.1 | 0.477 | |
| 4dqu | NAI | Enoyl-[acyl-carrier-protein] reductase [NADH] | 1.3.1.9 | 0.477 | |
| 3ml8 | ML8 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.474 | |
| 3uvp | 048 | Mitogen-activated protein kinase 14 | / | 0.474 | |
| 1yw2 | PGJ | Mitogen-activated protein kinase 14 | / | 0.473 | |
| 2itz | IRE | Epidermal growth factor receptor | 2.7.10.1 | 0.473 | |
| 3iw5 | DF3 | Mitogen-activated protein kinase 14 | / | 0.471 | |
| 3obg | SB2 | Mitogen-activated protein kinase 14 | / | 0.471 | |
| 4ewq | MWL | Mitogen-activated protein kinase 14 | / | 0.471 | |
| 2itq | ITQ | Epidermal growth factor receptor | 2.7.10.1 | 0.469 | |
| 3cjg | KIM | Vascular endothelial growth factor receptor 2 | 2.7.10.1 | 0.469 | |
| 3l8s | BFF | Mitogen-activated protein kinase 14 | / | 0.469 | |
| 4kla | CHD | Ferrochelatase, mitochondrial | 4.99.1.1 | 0.469 | |
| 4qa0 | SHH | Histone deacetylase 8 | 3.5.1.98 | 0.469 | |
| 3flw | FLW | Mitogen-activated protein kinase 14 | / | 0.467 | |
| 4dlj | 6RG | Mitogen-activated protein kinase 14 | / | 0.467 | |
| 3dt1 | P40 | Mitogen-activated protein kinase 14 | / | 0.466 | |
| 3rin | I2O | Mitogen-activated protein kinase 14 | / | 0.466 | |
| 2jed | LG8 | Protein kinase C theta type | 2.7.11.13 | 0.465 | |
| 4xxv | NAD | 3-isopropylmalate dehydrogenase | / | 0.464 | |
| 2ij7 | TPF | Mycocyclosin synthase | 1.14.21.9 | 0.463 | |
| 2zaz | GK1 | Mitogen-activated protein kinase 14 | / | 0.463 | |
| 4f64 | 0S8 | Fibroblast growth factor receptor 1 | / | 0.463 | |
| 1rek | B8L | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.462 | |
| 1xdd | AAY | Integrin alpha-L | / | 0.462 | |
| 3mpa | SB2 | Mitogen-activated protein kinase 14 | / | 0.462 | |
| 2y6o | 1N1 | Ephrin type-A receptor 4 | 2.7.10.1 | 0.461 | |
| 4gk2 | L66 | Ephrin type-A receptor 3 | 2.7.10.1 | 0.461 | |
| 4gk4 | L90 | Ephrin type-A receptor 3 | 2.7.10.1 | 0.461 | |
| 3fmn | 530 | Mitogen-activated protein kinase 14 | / | 0.460 | |
| 4kao | KAO | Focal adhesion kinase 1 | 2.7.10.2 | 0.460 | |
| 4mxx | DB8 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.460 | |
| 2z4z | SC0 | Geranylgeranyl pyrophosphate synthase | / | 0.459 | |
| 2zb0 | GK3 | Mitogen-activated protein kinase 14 | / | 0.459 | |
| 3gfe | P37 | Mitogen-activated protein kinase 14 | / | 0.459 | |
| 3iph | G11 | Mitogen-activated protein kinase 14 | / | 0.459 | |
| 3iw6 | PP0 | Mitogen-activated protein kinase 14 | / | 0.459 | |
| 3jyo | NAD | Quinate/shikimate dehydrogenase (NAD(+)) | / | 0.459 | |
| 3zsi | 52P | Mitogen-activated protein kinase 14 | / | 0.459 | |
| 4eh9 | IRG | Mitogen-activated protein kinase 14 | / | 0.459 | |
| 1syn | F89 | Thymidylate synthase | / | 0.458 | |
| 2aqh | NAI | Enoyl-[acyl-carrier-protein] reductase [NADH] | 1.3.1.9 | 0.458 | |
| 2chx | 090 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.458 | |
| 2ivp | ATP | tRNA N6-adenosine threonylcarbamoyltransferase | / | 0.458 | |
| 1u3d | FAD | Cryptochrome-1 | / | 0.457 | |
| 2itp | AEE | Epidermal growth factor receptor | 2.7.10.1 | 0.457 | |
| 2itt | AEE | Epidermal growth factor receptor | 2.7.10.1 | 0.457 | |
| 2z4w | 749 | Geranylgeranyl pyrophosphate synthase | / | 0.457 | |
| 2z4y | 252 | Geranylgeranyl pyrophosphate synthase | / | 0.457 | |
| 3fkl | FKL | Mitogen-activated protein kinase 14 | / | 0.457 | |
| 3new | 3NE | Mitogen-activated protein kinase 14 | / | 0.457 | |
| 3qiy | QI1 | Botulinum neurotoxin type A | 3.4.24.69 | 0.457 | |
| 4ia3 | BIV | Vitamin D3 receptor A | / | 0.457 | |
| 4ruo | BIV | Vitamin D3 receptor A | / | 0.457 | |
| 1e90 | MYC | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.456 | |
| 2i0e | PDS | Protein kinase C beta type | 2.7.11.13 | 0.456 | |
| 4j97 | ACP | Fibroblast growth factor receptor 2 | / | 0.456 | |
| 1bl6 | SB6 | Mitogen-activated protein kinase 14 | / | 0.455 | |
| 2brm | DFZ | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.455 | |
| 2e9u | A25 | Serine/threonine-protein kinase Chk1 | 2.7.11.1 | 0.455 | |
| 3d5q | T30 | Corticosteroid 11-beta-dehydrogenase isozyme 1 | 1.1.1.146 | 0.455 | |
| 3lxi | CAM | Cytochrome P450 | / | 0.455 | |
| 3ule | C69 | Actin-related protein 3 | / | 0.455 | |
| 4f63 | 0S7 | Fibroblast growth factor receptor 1 | / | 0.455 | |
| 1pr5 | TBN | Purine nucleoside phosphorylase DeoD-type | / | 0.454 | |
| 3c3e | FO1 | 2-phospho-L-lactate transferase | / | 0.454 | |
| 4aa4 | QC0 | Mitogen-activated protein kinase 14 | / | 0.454 | |
| 2qd5 | CHD | Ferrochelatase, mitochondrial | 4.99.1.1 | 0.453 | |
| 2w6z | L21 | Biotin carboxylase | 6.3.4.14 | 0.453 | |
| 3fml | FML | Mitogen-activated protein kinase 14 | / | 0.453 | |
| 3pp1 | IZG | Dual specificity mitogen-activated protein kinase kinase 1 | 2.7.12.2 | 0.453 | |
| 4bgb | ADP | Predicted molecular chaperone distantly related to HSP70-fold metalloproteases | / | 0.453 | |
| 3bv2 | P38 | Mitogen-activated protein kinase 14 | / | 0.452 | |
| 3uib | SB2 | Putative mitogen-activated protein kinase | / | 0.452 | |
| 3vrw | YS5 | Vitamin D3 receptor | / | 0.452 | |
| 4bc6 | XZN | Serine/threonine-protein kinase 10 | 2.7.11.1 | 0.452 | |
| 4cd2 | FOL | Dihydrofolate reductase | 1.5.1.3 | 0.452 | |
| 4nfn | 2KC | Tau-tubulin kinase 1 | 2.7.11.1 | 0.452 | |
| 4nks | 2M2 | Fibroblast growth factor receptor 1 | / | 0.452 | |
| 1onp | FOM | 1-deoxy-D-xylulose 5-phosphate reductoisomerase | 1.1.1.267 | 0.451 | |
| 2w6q | OA5 | Biotin carboxylase | 6.3.4.14 | 0.451 | |
| 3lfc | Z86 | Mitogen-activated protein kinase 14 | / | 0.451 | |
| 3lfe | Z84 | Mitogen-activated protein kinase 14 | / | 0.451 | |
| 2zba | ZBA | Trichothecene 3-O-acetyltransferase | / | 0.450 | |
| 3zhq | TPP | Multifunctional 2-oxoglutarate metabolism enzyme | 1.2.4.2 | 0.450 | |
| 1pyd | TDP | Pyruvate decarboxylase isozyme 1 | / | 0.449 | |
| 2dq7 | STU | Tyrosine-protein kinase Fyn | 2.7.10.2 | 0.449 | |
| 2pvy | ACP | Fibroblast growth factor receptor 2 | / | 0.449 | |
| 3bx5 | 304 | Mitogen-activated protein kinase 14 | / | 0.449 | |
| 3h18 | PMS | Esterase/lipase | / | 0.449 | |
| 3p6p | A6B | Camphor 5-monooxygenase | 1.14.15.1 | 0.449 | |
| 4ia7 | BIV | Vitamin D3 receptor A | / | 0.449 | |
| 4qmn | DB8 | Serine/threonine-protein kinase 24 | 2.7.11.1 | 0.449 | |
| 1i9c | 5AD | Glutamate mutase epsilon subunit | / | 0.448 | |
| 1sej | F89 | Bifunctional dihydrofolate reductase-thymidylate synthase | / | 0.448 | |
| 1yin | CM3 | Estrogen receptor | / | 0.448 | |
| 1zkl | IBM | High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A | 3.1.4.53 | 0.448 | |
| 4nka | 2K7 | Fibroblast growth factor receptor 1 | / | 0.448 | |
| 1e8z | STU | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.447 | |
| 3fln | 3FN | Mitogen-activated protein kinase 14 | / | 0.447 | |
| 3ml9 | ML9 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.447 | |
| 3nww | 3NW | Mitogen-activated protein kinase 14 | / | 0.447 | |
| 4ans | VGH | ALK tyrosine kinase receptor | 2.7.10.1 | 0.447 | |
| 4fhj | 0TZ | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.447 | |
| 4hvb | 19P | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.447 | |
| 4jrv | KJV | Epidermal growth factor receptor | 2.7.10.1 | 0.447 | |
| 4mxo | DB8 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.447 | |
| 4xiv | ACP | Chemotaxis protein CheA | 2.7.13.3 | 0.447 | |
| 3hl7 | I47 | Mitogen-activated protein kinase 14 | / | 0.446 | |
| 3o8t | BMU | Mitogen-activated protein kinase 14 | / | 0.446 | |
| 4h1j | 0YH | Protein-tyrosine kinase 2-beta | 2.7.10.2 | 0.446 | |
| 4ol0 | GTP | GTP-binding nuclear protein Ran | / | 0.446 | |
| 4twp | AXI | Tyrosine-protein kinase ABL1 | 2.7.10.2 | 0.446 | |
| 4wuo | NAD | 3-isopropylmalate dehydrogenase | 1.1.1.85 | 0.446 | |
| 1yqj | 6NP | Mitogen-activated protein kinase 14 | / | 0.445 | |
| 2giu | FBR | Estrogen receptor beta | / | 0.445 | |
| 2zym | ACX | Periplasmic binding protein | / | 0.445 | |
| 3c5u | P41 | Mitogen-activated protein kinase 14 | / | 0.445 | |
| 4aac | AAV | Mitogen-activated protein kinase 14 | / | 0.445 | |
| 4g09 | 0VD | Histidinol dehydrogenase | / | 0.445 | |
| 1lri | CLR | Beta-elicitin cryptogein | / | 0.444 | |
| 3nr4 | PYV | Abscisic acid receptor PYL2 | / | 0.444 | |
| 3vt8 | YI3 | Vitamin D3 receptor | / | 0.444 | |
| 4euf | NAD | Trans-2-enoyl-CoA reductase [NADH] | / | 0.444 | |
| 2a7r | 5GP | GMP reductase 2 | / | 0.443 | |
| 2j5x | GSP | ADP-ribosylation factor 6 | / | 0.443 | |
| 2of2 | 547 | Tyrosine-protein kinase Lck | 2.7.10.2 | 0.443 | |
| 2of4 | 979 | Tyrosine-protein kinase Lck | 2.7.10.2 | 0.443 | |
| 2zb4 | 5OP | Prostaglandin reductase 2 | 1.3.1.48 | 0.443 | |
| 3a99 | ANP | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.443 | |
| 3sgv | 2BJ | Ditrans,polycis-undecaprenyl-diphosphate synthase ((2E,6E)-farnesyl-diphosphate specific) | 2.5.1.31 | 0.443 | |
| 3vtb | TKA | Vitamin D3 receptor | / | 0.443 | |
| 3w8w | FAD | Putative FAD-dependent oxygenase EncM | / | 0.443 | |
| 4at0 | FAD | Possible succinate dehydrogenase | / | 0.443 | |
| 4eh6 | 0ON | Mitogen-activated protein kinase 14 | / | 0.443 | |
| 4gdy | 0X1 | Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial | 2.6.1.39 | 0.443 | |
| 4h97 | 53S | Dihydrofolate reductase | 1.5.1.3 | 0.443 | |
| 4k9y | K9Y | Focal adhesion kinase 1 | 2.7.10.2 | 0.443 | |
| 4rup | H97 | Vitamin D3 receptor A | / | 0.443 | |
| 1iwj | CAM | Camphor 5-monooxygenase | 1.14.15.1 | 0.442 | |
| 2qe4 | JJ3 | Estrogen receptor | / | 0.442 | |
| 3mvm | 39P | Mitogen-activated protein kinase 14 | / | 0.442 | |
| 3opd | HIE | Heat shock protein 83 | / | 0.442 | |
| 3uzw | NAP | 3-oxo-5-beta-steroid 4-dehydrogenase | / | 0.442 | |
| 3w1w | CHD | Ferrochelatase, mitochondrial | 4.99.1.1 | 0.442 | |
| 1rf9 | DBR | Camphor 5-monooxygenase | 1.14.15.1 | 0.441 | |
| 1szm | BI4 | cAMP-dependent protein kinase catalytic subunit alpha | 2.7.11.11 | 0.441 | |
| 1y57 | MPZ | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.441 | |
| 2zb1 | GK4 | Mitogen-activated protein kinase 14 | / | 0.441 | |
| 3ma3 | 01I | Serine/threonine-protein kinase pim-1 | 2.7.11.1 | 0.441 | |
| 3nmp | PYV | Abscisic acid receptor PYL2 | / | 0.441 | |
| 3vet | ADP | nebramycin 5' synthase | 6.1.2.2 | 0.441 | |
| 3vtc | TK3 | Vitamin D3 receptor | / | 0.441 | |
| 4anq | VGH | ALK tyrosine kinase receptor | 2.7.10.1 | 0.441 | |
| 5dhh | DGW | Nociceptin receptor | / | 0.441 | |
| 3uzc | T4E | Adenosine receptor A2a | / | 0.441 | |
| 1m17 | AQ4 | Epidermal growth factor receptor | 2.7.10.1 | 0.440 | |
| 1nbm | ADP | ATP synthase subunit beta, mitochondrial | 3.6.3.14 | 0.440 | |
| 1q3d | STU | Glycogen synthase kinase-3 beta | 2.7.11.26 | 0.440 | |
| 1uml | FR4 | Adenosine deaminase | 3.5.4.4 | 0.440 | |
| 1yrd | CAM | Camphor 5-monooxygenase | 1.14.15.1 | 0.440 | |
| 2chz | 093 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.440 | |
| 2x7g | PVB | SRSF protein kinase 2 | 2.7.11.1 | 0.440 | |
| 3a0i | AJI | Glucokinase | 2.7.1.2 | 0.440 | |
| 3r71 | X86 | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.440 | |
| 4dc0 | NDP | Putative ketoacyl reductase | 1.3.1 | 0.440 | |
| 4dgg | I76 | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.440 | |
| 4eh7 | 0OO | Mitogen-activated protein kinase 14 | / | 0.440 | |
| 4ia1 | BIV | Vitamin D3 receptor A | / | 0.440 | |
| 4ia2 | BIV | Vitamin D3 receptor A | / | 0.440 |