2R6E
Crystal Form B2
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.98 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 199.797, 199.797, 195.036 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 5.019 |
| R-factor | 0.39358 |
| Rwork | 0.393 |
| R-free | 0.39720 |
| Structure solution method | SAD |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 5.180 |
| High resolution limit [Å] | 5.000 | 5.000 |
| Number of reflections | 6233 | |
| <I/σ(I)> | 35.9 | 3.5 |
| Completeness [%] | 95.8 | 74.5 |
| Redundancy | 10.2 | 8.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7 | 2.5M Sodium Chloride, pH 7.0, VAPOR DIFFUSION |
