4O65
Crystal structure of the cupredoxin domain of amoB from Nitrosocaldus yellowstonii
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 77 |
Detector technology | CCD |
Collection date | 2010-06-13 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.97856 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 47.886, 47.886, 192.614 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 22.430 - 1.796 |
R-factor | 0.18347 |
Rwork | 0.181 |
R-free | 0.22874 |
Structure solution method | SAD |
RMSD bond length | 0.019 |
RMSD bond angle | 2.200 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHARP |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 22.430 | 7.842 |
High resolution limit [Å] | 1.796 | 1.796 |
Number of reflections | 20852 | |
Completeness [%] | 99.3 | 98.37 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 4 | 277.15 | 1 M NH4SO4, 100 mM sodium formate pH 4.0, and 2% polyethylene glycol 8000, VAPOR DIFFUSION, temperature 277.15K |