4LXC
The antimicrobial peptidase lysostaphin from Staphylococcus simulans
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.1 |
Synchrotron site | BESSY |
Beamline | 14.1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-02-01 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.918409 |
Spacegroup name | P 43 3 2 |
Unit cell lengths | 282.013, 282.013, 282.013 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.670 - 3.500 |
R-factor | 0.26873 |
Rwork | 0.268 |
R-free | 0.28684 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | pdb entries 1R77 2b0p |
RMSD bond length | 0.009 |
RMSD bond angle | 1.193 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.590 |
High resolution limit [Å] | 3.500 | 3.500 |
Rmerge | 0.295 | 0.908 |
Number of reflections | 48693 | |
<I/σ(I)> | 17.34 | 5.34 |
Completeness [%] | 100.0 | 100 |
Redundancy | 36.4 | 37.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 277 | 0.1 M MES and 1.6 M magnesium sulphate, 2 mM tetraglycine phosphinic acid. EDTA and ammonium sulphate as additives improved crystal quality, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |