4ODC
Crystal structure of Trematomus bernacchii hemoglobin in a partially cyanided state
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 5.2R |
| Synchrotron site | ELETTRA |
| Beamline | 5.2R |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-05-27 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 86.880, 87.880, 55.250 |
| Unit cell angles | 90.00, 99.66, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.540 |
| R-factor | 0.165 |
| Rwork | 0.165 |
| R-free | 0.19700 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 2peg |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELXS |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 30.000 |
| High resolution limit [Å] | 1.540 |
| Rmerge | 0.042 |
| Number of reflections | 61743 |
| Completeness [%] | 98.8 |
| Redundancy | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIQUID DIFFUSION | 7.6 | 293 | Crystallization of partially cyanided HbTb (CN-HbTb) was carried out at pH 7.6 and room temperature via liquid-diffusion technique, using a capillary. Precipitant solution: 10% (w/v) PEG MME 5000, 50 mM TRIS-HCl pH 7.6, LIQUID DIFFUSION, temperature 293K |
