2OIF
The crystal structure of ferric cyanide bound barley hexacoordinate hemoglobin.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2006-04-01 |
| Detector | RIGAKU RAXIS IV |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 45.740, 60.557, 145.804 |
| Unit cell angles | 99.17, 96.97, 92.43 |
Refinement procedure
| Resolution | 30.000 - 1.800 |
| R-factor | 0.20227 |
| Rwork | 0.200 |
| R-free | 0.24958 |
| Structure solution method | SAD |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.564 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.860 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.045 | 0.378 |
| Number of reflections | 123785 | |
| Completeness [%] | 87.4 | 47.8 |
| Redundancy | 3.7 | 2.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.3 | 277 | 20% PEG 3350, 0.2 M ammonium citrate, 4% polypropylene glycol, 0.1 M sodium cyanide, 0.01 M hepes, pH 5.3, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
