2VM4
Structure of Alcaligenes xylosoxidans nitrite reductase in space group R3 - 2 of 2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SRS BEAMLINE PX10.1 |
Synchrotron site | SRS |
Beamline | PX10.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARRESEARCH |
Spacegroup name | H 3 |
Unit cell lengths | 90.143, 90.143, 143.753 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 68.680 - 1.900 |
R-factor | 0.18 |
Rwork | 0.178 |
R-free | 0.21400 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1oe1 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.368 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.700 | |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.060 | 0.270 |
Number of reflections | 32080 | |
<I/σ(I)> | 15.5 | 3.2 |
Completeness [%] | 93.4 | 72.7 |
Redundancy | 3.2 | 2.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6.5 | pH 6.5 |