3D8G
Crystal structure of Staphylococcal nuclease variant Delta+PHS I72R at cryogenic temperature
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | OTHER |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-06-13 |
Detector | BRUKER APEX II |
Wavelength(s) | 1.5418 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 32.181, 60.425, 73.124 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 1.990 - 1.990 |
R-factor | 0.205 |
Rwork | 0.200 |
R-free | 0.25800 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | RCSB entry 1tqo all waters removed b = 20.0 ILE-72 and ILE-92 truncated to ALA |
RMSD bond length | 0.008 |
RMSD bond angle | 1.226 |
Data reduction software | SAINT |
Data scaling software | SAINT |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.600 | 2.090 |
High resolution limit [Å] | 1.990 | 1.990 |
Rmerge | 0.021 | 0.097 |
Number of reflections | 10279 | |
<I/σ(I)> | 42.54 | 9.87 |
Completeness [%] | 99.7 | 97.6 |
Redundancy | 20.75 | 9.35 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 277 | 25% MPD, 25 mM Potassium Phosphate, Calcium Chloride, pdTP, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K |