2W6X
Crystal structure of Sperm Whale Myoglobin mutant YQRF in complex with Xenon
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 | 2000-05-06 |
Detector | MARRESEARCH |
Spacegroup name | P 6 |
Unit cell lengths | 90.781, 90.781, 45.279 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.750 - 1.730 |
R-factor | 0.161 |
Rwork | 0.159 |
R-free | 0.19500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1naz |
RMSD bond length | 0.011 |
RMSD bond angle | 1.165 |
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] | 29.700 | 1.950 |
High resolution limit [Å] | 1.730 | 1.730 |
Rmerge | 0.080 | 0.030 |
Number of reflections | 21861 | |
<I/σ(I)> | 15.4 | 6.4 |
Completeness [%] | 100.0 | 99.9 |
Redundancy | 8.4 | 7.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.7 | 2.8M AMMONIUM SULFATE, 0.1M TRIS/HCL, PH8.7, HANGING DROP AT RT |