6ZZ9
Crystal structure of CbpB from Streptococcus agalactiae
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-01-28 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.071600 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 60.610, 60.610, 190.470 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.620 - 2.644 |
R-factor | 0.2341 |
Rwork | 0.233 |
R-free | 0.25230 |
Structure solution method | SAD |
RMSD bond length | 0.007 |
RMSD bond angle | 0.890 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | AutoSol |
Refinement software | BUSTER (2.10.3) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.620 | 2.739 |
High resolution limit [Å] | 2.644 | 2.644 |
Rmerge | 0.067 | 1.346 |
Rmeas | 0.077 | 1.538 |
Rpim | 0.036 | 0.738 |
Number of reflections | 11037 | 1030 |
<I/σ(I)> | 10.76 | |
Completeness [%] | 98.9 | 96.34 |
Redundancy | 4.3 | 4.2 |
CC(1/2) | 0.996 | 0.709 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 291 | 200 mM ammonium sulfate, 100 mM MES pH 6.5, 30% w/v PEG MME 5000 |