4A0E
Crystal structure of the cytoplasmic N-terminal domain of Yersinia pestis YscD
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-06-06 |
Detector | MARRESEARCH MX-300 |
Spacegroup name | P 4 3 2 |
Unit cell lengths | 118.227, 118.227, 118.227 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 39.409 - 2.042 |
R-factor | 0.2129 |
Rwork | 0.211 |
R-free | 0.25580 |
Structure solution method | SAD |
Starting model (for MR) | NONE |
RMSD bond length | 0.007 |
RMSD bond angle | 1.085 |
Data reduction software | HKL-3000 |
Data scaling software | SCALEPACK |
Phasing software | PHENIX |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.080 |
High resolution limit [Å] | 2.040 | 2.040 |
Rmerge | 0.060 | 0.640 |
Number of reflections | 18490 | |
<I/σ(I)> | 41.6 | 2.1 |
Completeness [%] | 98.9 | 99.3 |
Redundancy | 5.1 | 4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8.5 | 0.085M TRIS HCL PH 8.5, 25.5% (W/V) PEG 4000, 0.17M NA ACETATE, 15% (V/V) GLYCEROL, 10 MM TCEP HYDROCHLORIDE |