2XQV
The X-ray structure of the Zn(II) bound ZnuA from Salmonella enterica
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.1 |
| Synchrotron site | BESSY |
| Beamline | 14.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-01-22 |
| Detector | MARRESEARCH |
| Spacegroup name | P 63 |
| Unit cell lengths | 141.680, 141.680, 30.858 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 122.700 - 1.930 |
| R-factor | 0.20679 |
| Rwork | 0.206 |
| R-free | 0.22770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2prs |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.540 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0070) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.000 |
| High resolution limit [Å] | 1.930 | 1.930 |
| Rmerge | 0.080 | 0.430 |
| Number of reflections | 26743 | |
| <I/σ(I)> | 18.42 | 3.49 |
| Completeness [%] | 99.0 | 99.9 |
| Redundancy | 4.6 | 4.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | PEG 400 1.5%, AMMONIUM SULPHATE 2.3 M, HEPES 0.1 M PH 7.5 . |
