5HKL
Crystal structure of Mycobacterium tuberculosis H37Rv orotate phosphoribosyltransferase in complex with inorganic phosphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-02-13 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.90 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 57.262, 56.328, 59.470 |
| Unit cell angles | 90.00, 115.10, 90.00 |
Refinement procedure
| Resolution | 53.850 - 1.899 |
| R-factor | 0.15786 |
| Rwork | 0.156 |
| R-free | 0.19506 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5hki |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.828 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.210 | 1.967 |
| High resolution limit [Å] | 1.899 | 1.899 |
| Rmerge | 0.056 | 0.196 |
| Number of reflections | 26990 | |
| <I/σ(I)> | 13.6 | 4.78 |
| Completeness [%] | 99.1 | 95.53 |
| Redundancy | 3.2 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277.15 | 0.1M HEPES pH 7.5, 10% (w/v) PEG8000, 8% (v/v) Ethylene glycol, 1mM PRPP |
