4XBA
Hnt3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-08-20 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 52.761, 72.509, 53.926 |
| Unit cell angles | 90.00, 111.25, 90.00 |
Refinement procedure
| Resolution | 50.261 - 1.500 |
| R-factor | 0.1591 |
| Rwork | 0.157 |
| R-free | 0.19120 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3szq |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.569 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8.4_1496)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 72.510 | 1.580 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.070 | 0.831 |
| Number of reflections | 59945 | |
| <I/σ(I)> | 13.4 | 2.5 |
| Completeness [%] | 99.0 | 99.4 |
| Redundancy | 6.6 | 6.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 295 | 16%(w/v) PEG3350, 0.15 M Li2SO4, 0.1 M Tris-HCl, pH 8.0 |
