3N4U
app APH(2")-IVa form II
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-1 |
Synchrotron site | SSRL |
Beamline | BL9-1 |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.9795 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 46.380, 62.590, 96.490 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 28.610 - 2.200 |
R-factor | 0.183 |
Rwork | 0.178 |
R-free | 0.27280 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.042 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | PHENIX ((phenix.refine: 1.5_2)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 28.610 | 2.300 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.067 | 0.376 |
Number of reflections | 16313 | |
<I/σ(I)> | 13.8 | 2.3 |
Completeness [%] | 96.0 | 81 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |