1OYK
Crystal Structures of the Ferric, Ferrous, and Ferrous-NO Forms of the Asp140Ala Mutant of Human Heme Oxygenase-1: Catalytic Implications
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 119 |
Detector technology | IMAGE PLATE |
Collection date | 2002-04-18 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 55.665, 77.662, 100.318 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.590 |
R-factor | 0.23351 |
Rwork | 0.234 |
R-free | 0.29100 * |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1QQ8 |
RMSD bond length | 0.008 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS (1.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | |
High resolution limit [Å] | 2.590 | |
Rmerge | 0.066 * | 0.532 * |
Total number of observations | 135214 * | |
Number of reflections | 33028 * | |
<I/σ(I)> | 19.8 | |
Completeness [%] | 98.7 | |
Redundancy | 8.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.4 * | 301 | ammomium sulphate, 1,6 hexane-diol, HEPES, water, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 301K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | reservoir | ammonium sulfate | 2.08 (M) | |
2 | 1 | reservoir | HEPES | 100 (mM) | pH7.5 |
3 | 1 | reservoir | 1,6-hexanediol | 0.9 (%(v/v)) | |
4 | 1 | drop | protein | 45 (mg/ml) | |
5 | 1 | drop | potassium phosphate | 20 (mM) | pH7.4 |