4YEX
HUaa-19bp
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 12.3.1 |
| Synchrotron site | ALS |
| Beamline | 12.3.1 |
| Temperature [K] | 93.15 |
| Detector technology | CCD |
| Collection date | 2013-01-25 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 105.958, 49.951, 62.633 |
| Unit cell angles | 90.00, 114.70, 90.00 |
Refinement procedure
| Resolution | 56.900 - 3.200 |
| R-factor | 0.2205 |
| Rwork | 0.218 |
| R-free | 0.26260 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1mul |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.120 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | BUSTER-TNT (BUSTER 2.10.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.902 | 3.210 |
| High resolution limit [Å] | 3.199 | 3.199 |
| Rmerge | 0.057 | 0.574 |
| Total number of observations | 36802 | |
| Number of reflections | 5028 | |
| <I/σ(I)> | 20.1 | 3.301 |
| Completeness [%] | 99.6 | 100 |
| Redundancy | 7.3 | 7.64 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 5.5 | 298 | 0.1M Bis-Tris pH 5.5, 20% PEG 3350, 0.2M NH4F |
