Name
Title | ||
|---|---|---|
Diverse dynamics features of novel protein kinase C (PKC) isozymes determine the selectivity of a fluorinated balanol analogue for PKCε. |
Abstract | ||
|---|---|---|
For the first time to the best of our knowledge, we found that the origin of 1c selectivity for PKCε comes from the unique dynamics feature of each PKC isozyme. Fluorine conformational control in 1c can synergize with and lock down the dynamics of PKCε, which optimize binding interactions with the ATP site residues of the enzyme, particularly the invariant Lys437. This finding has implications for further rational design of balanol-based PKCε inhibitors for cancer drug development. |
Year | DOI | Venue |
|---|---|---|
2019 | 10.1186/s12859-018-2373-1 | BMC Bioinformatics |
Keywords | Field | DocType |
Fluorinated balanol analogue selectivity,Molecular dynamics simulations,Novel PKC isozymes,PKCε,Unique dynamics feature | Carcinogenesis,Biology,Ligand (biochemistry),Biochemistry,Ribose,Suppressor,Protein kinase C,Balanol,Genetics,Protein kinase A,Isozyme | Journal |
Volume | Issue | ISSN |
19 | 13 | 1471-2105 |
Citations | PageRank | References |
0 | 0.34 | 12 |
Authors | ||
4 | ||
Name | Order | Citations | PageRank |
|---|---|---|---|
| Ari Hardianto | 1 | 2 | 1.06 |
| Varun Khanna | 2 | 44 | 1.96 |
| Fei Liu | 3 | 2 | 1.06 |
| Shoba Ranganathan | 4 | 689 | 36.60 |