2OBL
Structural and biochemical analysis of a prototypical ATPase from the type III secretion system of pathogenic bacteria
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-03-01 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.973952 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 84.382, 77.609, 52.901 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 16.000 - 1.800 |
R-factor | 0.19704 |
Rwork | 0.195 |
R-free | 0.23173 |
Structure solution method | SAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.084 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXS |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.860 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.063 | 0.457 |
Number of reflections | 32089 | |
<I/σ(I)> | 182.3 | 3.18 |
Completeness [%] | 98.8 | 95.1 |
Redundancy | 15.3 | 11.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8 | 298 | 7% PEG 8000, 0.1M Calcium Acetate, 0.1 M Imidazole, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K |