3I9U
Crystal structure of the rat heme oxygenase (HO-1) in complex with heme binding dithioerythritol (DTE)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-6A |
Synchrotron site | Photon Factory |
Beamline | BL-6A |
Temperature [K] | 95 |
Detector technology | CCD |
Collection date | 2006-02-02 |
Detector | ADSC QUANTUM 4r |
Wavelength(s) | 1 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 65.882, 65.882, 120.244 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 30.000 - 2.250 |
R-factor | 0.16961 |
Rwork | 0.167 |
R-free | 0.22266 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3i9t |
RMSD bond length | 0.024 |
RMSD bond angle | 1.913 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.330 |
High resolution limit [Å] | 2.250 | 2.250 |
Number of reflections | 14964 | |
<I/σ(I)> | 32.1 | 7.04 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 7.2 | 7.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.4 | 293 | 3.2M sodium formate, 10mM sodium azide, 5mM DTV, pH7.4, VAPOR DIFFUSION, temperature 293K |