2F9W
Structure of the type III CoaA from Pseudomonas aeruginosa
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 | 2005-10-06 |
Detector | MARRESEARCH |
Wavelength(s) | 0.97911 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 90.667, 90.667, 179.194 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 49.880 - 1.900 |
R-factor | 0.21 |
Rwork | 0.210 |
R-free | 0.22500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2f9t |
RMSD bond length | 0.004 |
RMSD bond angle | 1.200 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.940 |
High resolution limit [Å] | 1.900 | 1.900 |
Number of reflections | 59606 | |
<I/σ(I)> | 30.5 | 4.4 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 12.7 | 10.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | water, Tirs-HCl, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291.0K |