4RPK
Crystal structure of Micobacterium tuberculosis UDP-Galactopyranose mutase in complex with tetrafluorinated substrate analog UDP-F4-Galf
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-03-08 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97949 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 173.550, 100.410, 101.270 |
| Unit cell angles | 90.00, 108.66, 90.00 |
Refinement procedure
| Resolution | 48.109 - 2.550 |
| R-factor | 0.1906 |
| Rwork | 0.188 |
| R-free | 0.24080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | MtUGM in complex with UDP-Galp (4RPG) |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.686 |
| Data reduction software | AutoProcess |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 48.109 | 2.620 | |
| High resolution limit [Å] | 2.550 | 11.400 | 2.550 |
| Rmerge | 0.145 | 0.091 | 0.825 |
| Number of reflections | 53750 | 626 | 3941 |
| <I/σ(I)> | 5.98 | 11.27 | 1.62 |
| Completeness [%] | 99.8 | 96.9 | 99.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Hanging drop vapor diffusion | 5.5 | 277 | 0.1M Bis-Tris pH 5.5, 20% PEG 3350, 3% MPD, Hanging drop vapor diffusion, temperature 277K |
