2FNW
Pseudomonas aeruginosa E2Q/H83Q/M109H-azurin RE(PHEN)(CO)3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE F2 |
Synchrotron site | CHESS |
Beamline | F2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-01-04 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.945 |
Spacegroup name | P 1 |
Unit cell lengths | 30.935, 38.334, 48.835 |
Unit cell angles | 100.50, 106.25, 109.43 |
Refinement procedure
Resolution | 30.000 - 1.400 |
Rwork | 0.196 |
R-free | 0.22700 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1bex |
RMSD bond length | 0.011 |
RMSD bond angle | 0.031 |
Data reduction software | DENZO |
Data scaling software | CCP4 ((TRUNCATE)) |
Phasing software | AMoRE |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.350 |
High resolution limit [Å] | 1.300 | 1.300 |
Number of reflections | 31077 | |
<I/σ(I)> | 17.4 | 1.8 |
Completeness [%] | 66.6 | 3.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 20% PEG molecular weight 4000, 100 mM LiNO3 and 100 mM imidazole pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K |