5OFG
Cu nitrite reductase serial data at varying temperatures RT 0.06MGy
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 298 |
Detector technology | PIXEL |
Collection date | 2014-12-15 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.8 |
Spacegroup name | P 21 3 |
Unit cell lengths | 96.237, 96.237, 96.237 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 55.560 - 1.490 |
R-factor | 0.16069 |
Rwork | 0.159 |
R-free | 0.18404 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5i6k |
RMSD bond length | 0.014 |
RMSD bond angle | 1.676 |
Data reduction software | XDS (VERSION Oct 15, 2015) |
Data scaling software | Aimless (0.5.17) |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 55.560 | 1.530 |
High resolution limit [Å] | 1.490 | 1.490 |
Rpim | 0.077 | 0.576 |
Number of reflections | 48509 | |
<I/σ(I)> | 5.3 | 1.2 |
Completeness [%] | 99.7 | 99.8 |
Redundancy | 3.3 | 3.3 |
CC(1/2) | 0.990 | 0.500 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | 100 mM sodium citrate at pH 5.0 and ~1.7 M ammonium sulphate |