2PWW
Crystal structure of ABC2387 from Bacillus clausii
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 | 2006-01-01 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9793 |
| Spacegroup name | P 64 |
| Unit cell lengths | 68.286, 68.286, 48.383 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 37.450 - 1.820 |
| R-factor | 0.201 |
| Rwork | 0.200 |
| R-free | 0.23400 |
| Structure solution method | SAD |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.462 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | HKL2Map |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.890 |
| High resolution limit [Å] | 1.820 | 1.820 |
| Rmerge | 0.107 | 0.502 |
| Number of reflections | 11674 | |
| <I/σ(I)> | 34.2 | 3.35 |
| Completeness [%] | 100.0 | 99.9 |
| Redundancy | 12.1 | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 298 | 0.1M Sodium MES pH 6.5, 10% PEG 20000, Cryo: 10% Ethylene glycol, VAPOR DIFFUSION, SITTING DROP, temperature 298K |
