4F55
Crystal Structure of the Catalytic Domain of the Bacillus cereus SleB Protein
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X29A |
| Synchrotron site | NSLS |
| Beamline | X29A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-01-01 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.075 |
| Spacegroup name | I 4 3 2 |
| Unit cell lengths | 134.626, 134.626, 134.626 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.740 - 1.850 |
| R-factor | 0.18121 |
| Rwork | 0.180 |
| R-free | 0.21172 |
| Structure solution method | SAD |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.572 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.880 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.092 | 0.555 |
| Number of reflections | 18099 | |
| <I/σ(I)> | 48.4 | 8.9 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 47.1 | 47.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.3 | 277 | 0.8 M ammonium phosphate and 0.05 sodium citrate, pH 5.3, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
