5AC7
S. enterica HisA with mutations D7N, D10G, dup13-15
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-07-04 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 61.999, 61.999, 607.094 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.106 - 1.904 |
| R-factor | 0.187 |
| Rwork | 0.185 |
| R-free | 0.21380 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5ahf |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.102 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.950 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.090 | 0.860 |
| Number of reflections | 56836 | |
| <I/σ(I)> | 30 | 1.71 |
| Completeness [%] | 99.8 | 99.1 |
| Redundancy | 37.6 | 37.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 2.0 M AMMONIUM SULFATE; 0.1 M BIS-TRIS PH5.5 |
