3WIA
Crystal structure of the N-terminal 1-37 residues deleted mutant of Geobacillus copper nitrite reductase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-06-24 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 0.9 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 89.317, 164.991, 126.561 |
Unit cell angles | 90.00, 102.27, 90.00 |
Refinement procedure
Resolution | 42.700 - 1.770 |
R-factor | 0.1723 |
Rwork | 0.171 |
R-free | 0.19243 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3wi9 |
RMSD bond length | 0.013 |
RMSD bond angle | 1.435 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 124.000 | 1.800 |
High resolution limit [Å] | 1.770 | 1.770 |
Number of reflections | 346257 | |
Completeness [%] | 98.6 | 98.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 289 | 0.1M Hepes-NaOH, 2.0M Ammonium formate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K |