4M7O
The crystal structure of a possible an iron-binding (periplasmic solute-binding) protein from Staphylococcus epidermidis ATCC 12228.
Experimental procedure
Experimental method | MAD |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-08-02 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97915, 0.97938 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 154.052, 48.173, 44.916 |
Unit cell angles | 90.00, 102.74, 90.00 |
Refinement procedure
Resolution | 34.720 - 2.020 |
R-factor | 0.1827 |
Rwork | 0.180 |
R-free | 0.22680 |
Structure solution method | MAD |
RMSD bond length | 0.007 |
RMSD bond angle | 0.991 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | SHELXD |
Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 2.050 |
High resolution limit [Å] | 2.020 | 2.020 |
Rmerge | 0.087 | 0.603 |
Number of reflections | 20707 | |
<I/σ(I)> | 20.5 | 1.9 |
Completeness [%] | 97.3 | 81.8 |
Redundancy | 3.3 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICRODIALYSIS | 6.5 | 289 | 0.1M MgCl2, 0.1M MES:NaOH, 30% (v/v) PEG400, pH 6.5, MICRODIALYSIS, temperature 289K |