4YSA
Completely oxidized structure of copper nitrite reductase from Geobacillus thermodenitrificans
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | FREE ELECTRON LASER |
| Source details | SACLA BEAMLINE BL3 |
| Synchrotron site | SACLA |
| Beamline | BL3 |
| Temperature [K] | 293 |
| Detector technology | CCD |
| Collection date | 2014-02-12 |
| Detector | MPCCD |
| Wavelength(s) | 1.129 |
| Spacegroup name | H 3 |
| Unit cell lengths | 116.197, 116.197, 85.553 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 34.750 - 1.430 |
| R-factor | 0.13734 |
| Rwork | 0.137 |
| R-free | 0.14915 |
| RMSD bond length | 0.029 |
| RMSD bond angle | 2.385 |
| Data reduction software | CrystFEL |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 34.800 |
| High resolution limit [Å] | 1.430 |
| Number of reflections | 79590 |
| <I/σ(I)> | 3.4 |
| Completeness [%] | 100.0 |
| Redundancy | 245.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 293 | 5.5% PEG 4000, 0.1M sodium acetate pH 4.5, 0.075M copper sulphate |
