2O64
Crystal structure of Pim1 with Quercetagetin
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.10000 |
| Spacegroup name | P 65 |
| Unit cell lengths | 97.755, 97.755, 80.970 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 84.510 - 2.440 |
| R-factor | 0.19114 |
| Rwork | 0.189 |
| R-free | 0.22957 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.497 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | CCP4 |
| Refinement software | REFMAC (5.1.25) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 84.510 | 2.504 |
| High resolution limit [Å] | 2.440 | 2.440 |
| Rmerge | 0.087 | 0.560 |
| Number of reflections | 15599 | |
| <I/σ(I)> | 8 | 2.3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 6 | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277 | NA ACETATE, IMIDAZOLE, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
