4ESX
Crystal structure of C. albicans Thi5 complexed with PLP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-02-17 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 55.157, 100.458, 126.198 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.349 - 2.200 |
| R-factor | 0.1738 |
| Rwork | 0.171 |
| R-free | 0.22750 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | The H66G mutant structure determined at 1.6 angstrom |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.061 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.7.3_928) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.240 |
| High resolution limit [Å] | 2.200 | 5.970 | 2.200 |
| Rmerge | 0.105 | 0.037 | 0.690 |
| Number of reflections | 36139 | ||
| <I/σ(I)> | 5.6 | ||
| Completeness [%] | 98.9 | 96 | 99.8 |
| Redundancy | 5.1 | 4.9 | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.3 | 295 | 20% PEG 3350, 0.2 M ammonium chloride, pH 5.3, vapor diffusion, hanging drop, temperature 295K |
