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 |
|---|---|---|---|
| 4o7l | ADP | Phosphoribosylaminoimidazole-succinocarboxamide synthase | 6.3.2.6 |
| PDB ID | HET | Uniprot Name | EC Number | Cavity Similarity |
Align |
|---|---|---|---|---|---|
| 4o7l | ADP | Phosphoribosylaminoimidazole-succinocarboxamide synthase | 6.3.2.6 | 1.000 | |
| 2ywv | ADP | Phosphoribosylaminoimidazole-succinocarboxamide synthase | / | 0.551 | |
| 2z02 | ATP | Phosphoribosylaminoimidazole-succinocarboxamide synthase | 6.3.2.6 | 0.503 | |
| 4o7n | ADP | Phosphoribosylaminoimidazole-succinocarboxamide synthase | 6.3.2.6 | 0.498 | |
| 4nye | ADP | Phosphoribosylaminoimidazole-succinocarboxamide synthase | 6.3.2.6 | 0.496 | |
| 4c1i | EH9 | cGMP-dependent 3',5'-cyclic phosphodiesterase | 3.1.4.17 | 0.483 | |
| 4f1s | F1S | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.477 | |
| 3oqu | A8S | Abscisic acid receptor PYL9 | / | 0.476 | |
| 4wq5 | ATP | tRNA N6-adenosine threonylcarbamoyltransferase | / | 0.473 | |
| 3njo | PYV | Abscisic acid receptor PYR1 | / | 0.471 | |
| 4jk4 | DIU | Serum albumin | / | 0.470 | |
| 4hvb | 19P | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.469 | |
| 5cpb | NAD | Enoyl-[acyl-carrier-protein] reductase [NADH] | 1.3.1.9 | 0.469 | |
| 3qk0 | QK0 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.467 | |
| 4ge4 | 0KE | Kynurenine/alpha-aminoadipate aminotransferase, mitochondrial | 2.6.1.39 | 0.466 | |
| 4wq4 | ATP | tRNA N6-adenosine threonylcarbamoyltransferase | / | 0.465 | |
| 5dr9 | SKE | Aurora kinase A | 2.7.11.1 | 0.465 | |
| 2bts | U32 | Cyclin-dependent kinase 2 | 2.7.11.22 | 0.464 | |
| 3vs7 | KS1 | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.464 | |
| 1pmn | 984 | Mitogen-activated protein kinase 10 | 2.7.11.24 | 0.463 | |
| 3ruk | AER | Steroid 17-alpha-hydroxylase/17,20 lyase | / | 0.463 | |
| 3gc9 | B45 | Mitogen-activated protein kinase 11 | 2.7.11.24 | 0.462 | |
| 3w9r | A8S | Abscisic acid receptor PYL9 | / | 0.459 | |
| 2fto | CB3 | Thymidylate synthase | / | 0.458 | |
| 2g2h | P16 | Tyrosine-protein kinase ABL1 | 2.7.10.2 | 0.458 | |
| 3njo | P2M | Abscisic acid receptor PYR1 | / | 0.458 | |
| 1f4g | TP4 | Thymidylate synthase | / | 0.457 | |
| 4htx | 19F | cGMP-dependent 3',5'-cyclic phosphodiesterase | 3.1.4.17 | 0.457 | |
| 2bbq | PFG | Thymidylate synthase | / | 0.456 | |
| 1tdu | DUR | Thymidylate synthase | / | 0.455 | |
| 4enh | FVX | Cholesterol 24-hydroxylase | / | 0.455 | |
| 4gyi | ADP | Uncharacterized protein | / | 0.454 | |
| 4o4e | ATP | Kinase | / | 0.454 | |
| 2e20 | B4P | Propionate kinase | / | 0.453 | |
| 4i0r | 1B4 | Tyrosine-protein kinase SYK | 2.7.10.2 | 0.453 | |
| 4rkd | KET | Aminotransferase | / | 0.453 | |
| 1kl2 | FON | Serine hydroxymethyltransferase | / | 0.452 | |
| 2ay8 | 4TB | Aromatic-amino-acid aminotransferase | 2.6.1.57 | 0.452 | |
| 3vs0 | VS0 | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.452 | |
| 3qaq | QAQ | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.451 | |
| 3vs3 | VSE | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.451 | |
| 4gyz | D5M | Tyrosyl-DNA phosphodiesterase 2 | 3.1.4 | 0.451 | |
| 1zdw | FLV | Prenyltransferase | / | 0.450 | |
| 3cgb | COA | Coenzyme A disulfide reductase | / | 0.450 | |
| 3vs2 | VSB | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.450 | |
| 1kzj | CB3 | Thymidylate synthase | / | 0.449 | |
| 2h8h | H8H | Proto-oncogene tyrosine-protein kinase Src | 2.7.10.2 | 0.449 | |
| 3e5a | VX6 | Aurora kinase A | 2.7.11.1 | 0.449 | |
| 4xey | 1N1 | Tyrosine-protein kinase ABL1 | 2.7.10.2 | 0.449 | |
| 2etm | 7PY | Focal adhesion kinase 1 | 2.7.10.2 | 0.448 | |
| 2j0l | ANP | Focal adhesion kinase 1 | 2.7.10.2 | 0.448 | |
| 3nj0 | PYV | Abscisic acid receptor PYL2 | / | 0.448 | |
| 3vrz | VRZ | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.448 | |
| 4bch | T7Z | Cyclin-dependent kinase 9 | 2.7.11.22 | 0.448 | |
| 1x2h | LPA | Lipoate-protein ligase A | 6.3.1.20 | 0.447 | |
| 3mtf | A3F | Activin receptor type-1 | 2.7.11.30 | 0.447 | |
| 4i0t | 1B6 | Tyrosine-protein kinase SYK | 2.7.10.2 | 0.447 | |
| 5dpv | SKE | Aurora kinase A | 2.7.11.1 | 0.447 | |
| 3lki | ATP | Fructokinase | / | 0.446 | |
| 3r6p | A8S | Abscisic acid receptor PYL10 | / | 0.446 | |
| 4anx | 534 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.446 | |
| 4c58 | 824 | Cyclin-G-associated kinase | 2.7.11.1 | 0.446 | |
| 4fjz | 4FJ | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.446 | |
| 4hle | 17V | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.446 | |
| 4ux9 | ANP | Mitogen-activated protein kinase 8 | 2.7.11.24 | 0.446 | |
| 1nmd | ATP | Major actin | / | 0.445 | |
| 2ptf | FMN | Uncharacterized protein MTH_863 | / | 0.444 | |
| 3oom | 507 | Activin receptor type-1 | 2.7.11.30 | 0.444 | |
| 4o4f | ATP | Kinase | / | 0.444 | |
| 4ydu | ADP | tRNA N6-adenosine threonylcarbamoyltransferase | / | 0.444 | |
| 1u2g | APR | NAD(P) transhydrogenase subunit alpha part 1 | 1.6.1.2 | 0.443 | |
| 3ml9 | ML9 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.443 | |
| 3tm5 | SFG | Uncharacterized protein | / | 0.443 | |
| 1o02 | NAD | Aldehyde dehydrogenase, mitochondrial | 1.2.1.3 | 0.442 | |
| 2j0m | 4ST | Focal adhesion kinase 1 | 2.7.10.2 | 0.442 | |
| 3acy | 702 | Dehydrosqualene synthase | / | 0.442 | |
| 3cin | NAD | Myo-inositol-1-phosphate synthase-related protein | / | 0.442 | |
| 4fjy | FJY | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.442 | |
| 2ay9 | 5PV | Aromatic-amino-acid aminotransferase | 2.6.1.57 | 0.441 | |
| 2fto | TMP | Thymidylate synthase | / | 0.441 | |
| 2y1o | T26 | UDP-N-acetylmuramoylalanine--D-glutamate ligase | 6.3.2.9 | 0.441 | |
| 3vrw | YS5 | Vitamin D3 receptor | / | 0.441 | |
| 3zec | ANP | Adenosine monophosphate-protein transferase SoFic | 2.7.7.n1 | 0.441 | |
| 4ea1 | 3RX | Dehydrosqualene synthase | / | 0.441 | |
| 4fad | 0TB | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.441 | |
| 4z64 | ILE_THR_GLN_TYS_TYS | Phytosulfokine receptor 1 | 2.7.11.1 | 0.441 | |
| 1jm6 | ADP | [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 2, mitochondrial | 2.7.11.2 | 0.440 | |
| 1qcf | PP1 | Tyrosine-protein kinase HCK | 2.7.10.2 | 0.440 | |
| 1s9d | AFB | Cytohesin-2 | / | 0.440 | |
| 1s9d | AFB | ADP-ribosylation factor 1 | / | 0.440 | |
| 2ay3 | MPP | Aromatic-amino-acid aminotransferase | 2.6.1.57 | 0.440 | |
| 3qw4 | U5P | Orotidine-5-phosphate decarboxylase/orotate phosphoribosyltransferase, putative | / | 0.440 | |
| 3zw3 | ZW3 | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform | 2.7.1.153 | 0.440 | |
| 4bge | PYW | Enoyl-[acyl-carrier-protein] reductase [NADH] | 1.3.1.9 | 0.440 | |
| 4ds8 | A8S | Abscisic acid receptor PYL3 | / | 0.440 | |
| 4ia7 | BIV | Vitamin D3 receptor A | / | 0.440 | |
| 5ecc | NAP | Dehydrofolate reductase type I | / | 0.440 |