5VE6
Crystal structure of Sugen kinase 223
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-02-17 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9537, 0.9796 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 144.683, 144.683, 47.445 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.753 - 2.953 |
| R-factor | 0.2221 |
| Rwork | 0.218 |
| R-free | 0.26240 |
| Structure solution method | MAD |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.652 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | Auto-Rickshaw |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.753 | 3.130 |
| High resolution limit [Å] | 2.950 | 2.950 |
| Number of reflections | 20160 | 3203 |
| <I/σ(I)> | 3.85 | |
| Completeness [%] | 98.0 | |
| Redundancy | 8.5 | 8.38 |
| CC(1/2) | 0.999 | 0.893 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 7.5 | 298 | 0.1M Hepes pH 7.5, 1.6M NaH2PO4/KH2PO4 |
