2W5U
Flavodoxin from Helicobacter pylori in complex with the C3 inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 120 |
Detector technology | CCD |
Collection date | 2008-05-10 |
Detector | ENRAF-NONIUS |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 38.533, 50.967, 72.806 |
Unit cell angles | 90.00, 98.64, 90.00 |
Refinement procedure
Resolution | 22.000 - 2.620 |
R-factor | 0.227 |
Rwork | 0.227 |
R-free | 0.26400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1fue |
RMSD bond length | 0.011 |
RMSD bond angle | 1.580 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 22.000 | 2.700 |
High resolution limit [Å] | 2.620 | 2.600 |
Rmerge | 0.110 | 0.260 |
Number of reflections | 8523 | |
<I/σ(I)> | 9.7 | 7.9 |
Completeness [%] | 99.8 | 98.7 |
Redundancy | 6 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |