1S5X
The crystal structure of Trematomus bernacchii hemoglobin oxidized by air
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | ENRAF-NONIUS |
Temperature [K] | 293 |
Detector technology | IMAGE PLATE |
Collection date | 2002-07-02 |
Detector | MAC Science DIP-2030B |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 108.516, 65.095, 55.750 |
Unit cell angles | 90.00, 113.48, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.400 |
R-factor | 0.195 |
Rwork | 0.190 |
R-free | 0.23300 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.400 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.490 |
High resolution limit [Å] | 2.400 | 2.400 |
Rmerge | 0.346 | |
Number of reflections | 14020 | |
Completeness [%] | 99.5 | 99.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIQUID DIFFUSION | 7.6 | 293 | MPEG 5000, Tris, pH 7.6, LIQUID DIFFUSION, temperature 293K |