9GSR
Crystal Structure of M. hassiacum GPGS co-crystallized with UDP-Glucose (pH 7.2)
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 | 2013-06-20 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.96112 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 71.371, 90.548, 95.307 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.320 - 1.250 |
| R-factor | 0.1493 |
| Rwork | 0.148 |
| R-free | 0.16670 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.933 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.1_5286) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.290 |
| High resolution limit [Å] | 1.250 | 1.250 |
| Rmerge | 0.047 | 0.590 |
| Rpim | 0.024 | 0.352 |
| Number of reflections | 168628 | 15671 |
| <I/σ(I)> | 14.6 | 1.8 |
| Completeness [%] | 98.9 | 83.5 |
| Redundancy | 4.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 293 | 0.2M Potassium Sodium Tartrate pH 7.2, 20% PEG 3350 |
