2E2Y
Crystal Structure of F43W/H64D/V68I Myoglobin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-11-22 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 6 |
Unit cell lengths | 90.651, 90.651, 45.447 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 39.340 - 1.600 |
R-factor | 0.16959 |
Rwork | 0.168 |
R-free | 0.19543 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lue |
RMSD bond length | 0.009 |
RMSD bond angle | 1.179 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.000 | 1.660 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.068 | 0.299 |
Number of reflections | 28285 | |
<I/σ(I)> | 23.7 | 10.7 |
Completeness [%] | 99.8 | 99.4 |
Redundancy | 11.5 | 7.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | 2.2M Ammonium Sulfate, 20mM Tris/HCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K |