2V9C
X-ray Crystallographic Structure of a Pseudomonas aeruginosa Azoreductase in Complex with Methyl Red.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-04-25 |
Detector | ADSC CCD |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 82.550, 82.550, 108.650 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 34.000 - 2.180 |
Rwork | 0.194 |
R-free | 0.24200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | PDB ENTRIES 1V4B AND 1T5B |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 34.000 | 2.300 |
High resolution limit [Å] | 2.180 | 2.180 |
Rmerge | 0.060 | 0.460 |
Number of reflections | 20681 | |
<I/σ(I)> | 9.7 | 1.6 |
Completeness [%] | 97.4 | 88.8 |
Redundancy | 3.5 | 2.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 1.6 M AMMONIUM SULFATE, 0.1 M HEPES, PH 7.5. |