Table 2.
Hots spots based on the mapping of bound and unbound target structures
| Target Name | Hot Spot Structure | PDB ID | Chai n | Bound | PDB ID | Chai n | Unbound |
|---|---|---|---|---|---|---|---|
| FTMap Associated Hotspots | FTMap Associated Hotspots | ||||||
| Thrombin | Complex I | 1DWC | H | 0(26), 2(14), 5(6), 6(6), 7 (5) | 1SGI | E | 0(28), 1 (16), 2(15), 4(11) |
| MAP Kinase P38 | Complex I | 2YIS | A | 0(26), 1 (21), 2 (10), 3 (7) | 4E5B | A | 0(15), 1 (13), 2(12), 5(10) |
| Renin | Complex I | 2V0Z | C | 0 (24), 1 (15), 2 (12), 3 (8), 4 (8), 5 (7), 6 (7) | 1BBS | A | 0 (23), 1 (19), 2 (15), 3 (9), 4 (8), 5 (8), 6 (7) |
| PPAR-γ | Complex I | 3FUR | A | 2 (9), 4 (8), 5 (8), 6 (7), 8 (6) | 2HW R | B | 0 (23), 1 (9), 2 (9), 3 (9), 4 (9), 5 (7), 6 (6), 7 (6), 8 (6), 9 (6) |
| Epidermal Growth Factor Receptor | Complex II | 1XKK | A | 0 (16), 1 (15), 2 (12), 3 (9), 5 (7), 6 (7) | 4TKS | A | 0(20), 1 (20), 2 (17), 3 (14), 4 (5) |
| Hepatocyte Growth Factor Receptor | Complex II | 3F82 | A | 0 (14), 1 (12), 2 (11), 3 (10), 4 (9), 5 (8), 7 (6) | 1R1W | A | 0 (16), 2 (13), 3 (10), 5 (8), 6 (7), 7 (5), 9 (5) |
| Anaplastic Lymphoma Kinase | Complex II | 4MKC | A | 0 (24), 3 (8), 5 (6), 6 (6), 7 (5) | 4FNX | A | 0 (23), 1 (20) |
| Tyrosine Protein Kinase ABL1 | Complex II | 3CS9 | A | 0(20), 2(15), 3(14), 4(13) | 2HZ4 | C | 0(26), 1 (19), 2(11) |
| VEGFR- 2 | Complex II | 3C7Q | A | 0 (20), 1 (17), 2 (10), 3 (9), 4 (8), 6 (8), 7 (6) | 1VR2 | A | 0 (26), 1 (14), 2 (13), 3 (12), 4 (12), 5 (7), 6 (6) |
| Polo-like Kinase 1 | Complex II | 3FC2 | A | 0(28), 1 (19), 2(12), 3(7), 7(5) | 2V5Q | A | 0(25), 1 (15), 3(11), 4 (9) |
| Cyclophilin A | Complex III | 1CWA | A | 0(27), 1 (16), 4(11), 5 (6) | 5KV0 | A | 0 (26), 2 (11), 3 (11), 6 (5) |
| Bcl-2 | Complex III | 4LVT | A | 0(22), 2 (17), 4 (10), 5 (5) | 1GJH | A | 0 (20), 1 (14), 4 (12) |
| Phosphoinositide-3 Kinase | Simple | 3DBS | A | 4 (8) | 1E8Y | A | 0 (16) |
| Protein Farnesyltransferase | Simple | 1O5M | A B | 0 (19), 2 (15) | 1FT1 | B | 1 (17), 3 (16) |
| Kinesin Eg5 | Simple | 4A5Y | A | 0 (17), 2 (17), 3 (12) | 4A28 | A | 1 (19) |
| Hepatitis C Virus NS5b Subunit | Simple | 4NLD | A | 2 (10) | 2ZKU | B | - |
| Hepatitis C Virus NS34A Protease | Simple | 3KEE | A E | 1 (16), 3(10) | 1DXP | A | - |
| Tubulin-Alpha Chain | Simple | 1JFF | B | 2 (16), 5 (8) | 2XRP | G | 2 (17), 4 (10) |
| Integrin Alpha-11B | Simple | 2VDN* | B | 2 (17) | 2VDL | B | 3 (13) |
| Na-K ATPase | Simple | 3A3Y | A | 1 (17), 2(12), 3 (8) | 5AW8 | A | 0(10), 6(5), 11 (5) |
| α-Amylase | Simple | 1PPI | A | 0 (18), 1 (16), 3 (11) | 1KXV | A | 1 (15), 2(14), 3(12) |
*
Indicates domain splitting was performed prior to FTMap (see Methods)