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 |