4E5S
Crystal structure of MccFlike protein (BA_5613) from Bacillus anthracis str. Ames
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 | 2012-01-29 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 74.585, 85.804, 125.148 |
| Unit cell angles | 90.00, 92.00, 90.00 |
Refinement procedure
| Resolution | 32.518 - 1.952 |
| R-factor | 0.1555 |
| Rwork | 0.153 |
| R-free | 0.20210 |
| Structure solution method | SAD |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.810 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((phenix.refine: 1.7.3_928)/REFMAC) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.000 | 1.980 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.075 | |
| Number of reflections | 113744 | |
| <I/σ(I)> | 17 | |
| Completeness [%] | 99.5 | 100 |
| Redundancy | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 289 | 25% PEG 3350, 0.1 M TRIS, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
