5KXR
Hen Egg White Lysozyme at 278K, Data set 3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL14-1 |
Synchrotron site | SSRL |
Beamline | BL14-1 |
Temperature [K] | 278 |
Detector technology | CCD |
Collection date | 2013-07-19 |
Detector | MARMOSAIC 325 mm CCD |
Wavelength(s) | 1.21549 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 79.143, 79.143, 37.951 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.410 - 1.200 |
R-factor | 0.1652 |
Rwork | 0.164 |
R-free | 0.18740 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 2blx |
RMSD bond length | 0.025 |
RMSD bond angle | 2.355 |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.20) |
Refinement software | REFMAC (5.8.0151) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 31.410 | 31.410 | 1.260 |
High resolution limit [Å] | 1.198 | 3.790 | 1.200 |
Rmerge | 0.100 | 0.609 | |
Rmeas | 0.128 | 0.117 | 0.719 |
Rpim | 0.063 | 0.058 | 0.368 |
Total number of observations | 125401 | 4148 | 14553 |
Number of reflections | 35857 | ||
<I/σ(I)> | 9.8 | 18.6 | 1.8 |
Completeness [%] | 93.9 | 93.1 | 86.7 |
Redundancy | 3.5 | 3.3 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 291 | CRYSTALS WERE GROWN BY MIXING EQUAL VOLUMES OF WELL SOLUTION (1.0 M SODIUM CHLORIDE, 50 MM SODIUM ACETATE PH 4.5) AND PROTEIN (40-60 MG/ML) |