5GK0
Crystal structure of selnomethionin-labeled ketosynthase StlD
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NE3A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NE3A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-06-14 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 0.9788 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 63.220, 127.710, 108.020 |
| Unit cell angles | 90.00, 91.39, 90.00 |
Refinement procedure
| Resolution | 41.730 - 2.331 |
| R-factor | 0.1877 |
| Rwork | 0.186 |
| R-free | 0.22700 |
| Structure solution method | SAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.958 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | AutoSol ((1.10.1_2155)) |
| Refinement software | PHENIX ((1.10.1_2155)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.470 |
| High resolution limit [Å] | 2.300 | 2.330 |
| Rmerge | 0.045 | 0.151 |
| Number of reflections | 143308 | |
| <I/σ(I)> | 20.32 | 8.03 |
| Completeness [%] | 99.3 | 97.9 |
| Redundancy | 3.81 | 3.67 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 12.5% PEG 4000, 100mM Tris-HCl (pH7.5) |
