5IHW
The crystal structure of SdrE from staphylococcus aureus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U |
Synchrotron site | SSRF |
Beamline | BL17U |
Temperature [K] | 173 |
Detector technology | CCD |
Collection date | 2013-04-11 |
Detector | MARRESEARCH |
Wavelength(s) | 0.9782 |
Spacegroup name | P 1 |
Unit cell lengths | 39.260, 41.560, 51.140 |
Unit cell angles | 95.59, 97.55, 99.55 |
Refinement procedure
Resolution | 50.320 - 1.250 |
R-factor | 0.1444 |
Rwork | 0.143 |
R-free | 0.17640 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5cf3 |
RMSD bond length | 0.025 |
RMSD bond angle | 2.263 |
Data reduction software | iMOSFLM |
Data scaling software | SCALEPACK |
Phasing software | PHENIX |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.320 |
High resolution limit [Å] | 1.250 |
Rmerge | 0.056 |
Number of reflections | 75580 |
<I/σ(I)> | 8.1 |
Completeness [%] | 87.0 |
Redundancy | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2mol/L CaCl2, 35% PEG 3350, 0.1mol/L, Bis-Tris pH 6.6 |