4J41
The crystal structure of a secreted protein EsxB (Mutant P67A) from Bacillus anthracis str. Sterne
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-04-04 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 45.511, 96.200, 134.371 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.600 - 1.522 |
| R-factor | 0.1825 |
| Rwork | 0.181 |
| R-free | 0.20300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4j10 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.802 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.8.1_1168)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.600 | 1.550 |
| High resolution limit [Å] | 1.520 | 1.520 |
| Rmerge | 0.049 | 0.373 |
| Number of reflections | 89122 | |
| <I/σ(I)> | 32.8 | 2.6 |
| Completeness [%] | 97.5 | |
| Redundancy | 4.5 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 277 | 0.1M Sodium Citrate:Citric Acid, 40% (v/v) PEG600, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |
