2AC4
Crystal structure of the His183Cys mutant variant of Bacillus subtilis Ferrochelatase
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 | 2004-10-14 |
Detector | MARRESEARCH |
Wavelength(s) | 1.094 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 48.700, 49.800, 119.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.100 |
R-factor | 0.214 |
Rwork | 0.214 |
R-free | 0.27600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1doz |
RMSD bond length | 0.006 |
RMSD bond angle | 1.200 |
Data scaling software | XDS |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.230 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.090 | 0.227 |
Number of reflections | 16999 | |
Completeness [%] | 97.1 | 88.9 |
Redundancy | 4.5 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.4 | 298 | PEG 2000, magnesium chloride, tris, pH 7.4, VAPOR DIFFUSION, temperature 298K |