2G5G
Cofacial heme binding to ChaN of Campylobacter jejuni
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL1-5 |
Synchrotron site | SSRL |
Beamline | BL1-5 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-04-08 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.978726 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 87.918, 58.790, 82.395 |
Unit cell angles | 90.00, 119.21, 90.00 |
Refinement procedure
Resolution | 36.000 - 1.900 |
R-factor | 0.20902 |
Rwork | 0.207 |
R-free | 0.24172 |
Structure solution method | SAD |
RMSD bond length | 0.014 |
RMSD bond angle | 1.437 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 36.000 | 1.970 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.084 | 0.333 |
Number of reflections | 28754 | |
<I/σ(I)> | 8.638 | 2.699 |
Completeness [%] | 99.0 | 97.9 |
Redundancy | 3.48 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 298 | 15% PEG 4000, 100 mM HEPES, pH 7.0, vapor diffusion, hanging drop, temperature 298K |