4WK3
Structure of Staphyloccus aureus PstA
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06SA |
Synchrotron site | SLS |
Beamline | X06SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-09-10 |
Detector | PSI PILATUS 6M |
Wavelength(s) | 0.99998 |
Spacegroup name | P 43 3 2 |
Unit cell lengths | 99.320, 99.320, 99.320 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.417 - 2.600 |
R-factor | 0.2555 |
Rwork | 0.252 |
R-free | 0.29190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3m05 |
RMSD bond length | 0.009 |
RMSD bond angle | 1.176 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 70.200 | 2.670 |
High resolution limit [Å] | 2.600 | 2.600 |
Number of reflections | 5565 | |
<I/σ(I)> | 33.1 | 2.5 |
Completeness [%] | 99.9 | 99.2 |
Redundancy | 36.2 | 36.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 55% v/v MPD, 0.1 M sodium-acetate pH 4.3, 10 mM calcium chloride |