5TO0
HTRA2 S276C mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-3 |
Synchrotron site | ESRF |
Beamline | ID14-3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-06-30 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.931 |
Spacegroup name | H 3 |
Unit cell lengths | 83.824, 83.824, 127.464 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.894 - 1.900 |
R-factor | 0.1576 |
Rwork | 0.150 |
R-free | 0.17750 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lcy |
RMSD bond length | 0.010 |
RMSD bond angle | 0.921 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 63.100 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.044 | 0.512 |
Number of reflections | 26268 | |
<I/σ(I)> | 30 | 4.4 |
Completeness [%] | 99.8 | |
Redundancy | 8.4 | 8.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.1 M MES pH 6.0, 1 M LiCl, and 15-20% (w/v) PEG-6000 |