4XH6
Crystal structure of proto-oncogene kinase Pim1 bound to hispidulin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44XU |
| Synchrotron site | SPring-8 |
| Beamline | BL44XU |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-11-22 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 0.9 |
| Spacegroup name | P 65 |
| Unit cell lengths | 97.999, 97.999, 80.599 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 42.435 - 2.040 |
| R-factor | 0.20152 |
| Rwork | 0.200 |
| R-free | 0.22574 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2o3p |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.346 |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.110 |
| High resolution limit [Å] | 2.040 | 2.040 |
| Rmerge | 0.068 | |
| Number of reflections | 28099 | |
| <I/σ(I)> | 9.7 | 2.1 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 5.7 | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.1 | 277 | 1M NaOAc, 0.1M Imidazole |
