5G5U
Crystal structure of NagZ H174A mutant from Pseudomonas aeruginosa
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALBA BEAMLINE XALOC |
| Synchrotron site | ALBA |
| Beamline | XALOC |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-10-23 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 64.231, 75.620, 76.720 |
| Unit cell angles | 90.00, 110.40, 90.00 |
Refinement procedure
| Resolution | 60.202 - 2.250 |
| R-factor | 0.1771 |
| Rwork | 0.174 |
| R-free | 0.23170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | APO STRUCTURE OF NAGZ FROM PSEUDOMONAS AERUGINOSA |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.986 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.200 | 2.320 |
| High resolution limit [Å] | 2.250 | 2.250 |
| Rmerge | 0.170 | 0.860 |
| Number of reflections | 32273 | |
| <I/σ(I)> | 8.8 | 3.7 |
| Completeness [%] | 98.5 | 98.2 |
| Redundancy | 4.5 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6 | 30% PEG 8000 100 MM SODIUM CACODYLATE PH 6.0 200 MM SODIUM ACETATE PH 6.0 5 MM EDTA |
