5DXF
Structure of Candida albicans trehalose-6-phosphate phosphatase N-terminal domain
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-ID |
| Synchrotron site | APS |
| Beamline | 22-ID |
| Temperature [K] | 200 |
| Detector technology | CCD |
| Collection date | 2013-10-07 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 1 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 98.311, 98.311, 452.832 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.868 - 2.563 |
| R-factor | 0.2673 |
| Rwork | 0.266 |
| R-free | 0.29820 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1uqu |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.986 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.600 |
| High resolution limit [Å] | 2.560 | 6.940 | 2.560 |
| Rmerge | 0.098 | 0.033 | 0.525 |
| Total number of observations | 258931 | ||
| Number of reflections | 42110 | ||
| <I/σ(I)> | 9.2 | ||
| Completeness [%] | 97.6 | 88.6 | 92.2 |
| Redundancy | 6.1 | 4.4 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 298 | 0.1 M sodium cacodylate, 1.2 M sodium citrate |
