4CBV
X-ray structure of full-length ComE from Streptococcus pneumoniae.
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 | CCD |
| Collection date | 2010-09-23 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 88.893, 135.004, 461.395 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.950 - 3.390 |
| R-factor | 0.1978 |
| Rwork | 0.196 |
| R-free | 0.22290 |
| Structure solution method | SAD |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.970 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SHARP |
| Refinement software | BUSTER (2.10.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.000 | 3.590 |
| High resolution limit [Å] | 3.400 | 3.390 |
| Rmerge | 0.110 | 0.510 |
| Number of reflections | 71134 | |
| <I/σ(I)> | 10.9 | 2.84 |
| Completeness [%] | 95.6 | 87.6 |
| Redundancy | 3.77 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 1.8M DL-MALIC ACID, pH 7.5 |
