2DWS
Cu-containing nitrite reductase at pH 8.4 with bound nitrite
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I711 |
Synchrotron site | MAX II |
Beamline | I711 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-06-18 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.996 |
Spacegroup name | H 3 |
Unit cell lengths | 82.204, 82.204, 146.152 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 26.460 - 1.850 |
Rwork | 0.168 |
R-free | 0.19900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1zv2 |
RMSD bond length | 0.013 |
RMSD bond angle | 1.575 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.460 | 1.920 |
High resolution limit [Å] | 1.850 | 1.850 |
Number of reflections | 31708 | |
Completeness [%] | 100.0 | 100 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.4 | 298 | Tris, MgCl2, NaNO2, PEG 4000, pH 8.4, VAPOR DIFFUSION, HANGING DROP, temperature 298K |