3QAY
Catalytic domain of CD27L endolysin targeting Clostridia Difficile
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE X12 |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | X12 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-01-06 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 1 |
Unit cell lengths | 36.507, 69.737, 78.818 |
Unit cell angles | 101.72, 102.00, 105.24 |
Refinement procedure
Resolution | 20.000 - 2.000 |
R-factor | 0.18698 |
Rwork | 0.184 |
R-free | 0.24571 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1xov |
RMSD bond length | 0.007 |
RMSD bond angle | 0.983 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.900 |
High resolution limit [Å] | 1.870 | 1.870 |
Rmerge | 0.137 | 0.310 |
Number of reflections | 50589 | |
<I/σ(I)> | 8.9 | 2.3 |
Completeness [%] | 88.3 | 69.8 |
Redundancy | 1.8 | 1.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.2 | 292 | 0.1 M Tris-HCl, 0.2 M LiSO4, 20 % PEG 4000, pH 8.2, VAPOR DIFFUSION, HANGING DROP, temperature 292K |