5AHF
Crystal structure of Salmonella enterica HisA D7N with ProFAR
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-09-12 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 86.698, 86.698, 121.861 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.312 - 2.201 |
| R-factor | 0.1722 |
| Rwork | 0.170 |
| R-free | 0.21800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.141 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.310 | 2.330 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.140 | 1.250 |
| Number of reflections | 25987 | |
| <I/σ(I)> | 14.09 | 1.8 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 10 | 9.66 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 0.2 M AMMONIUM ACETATE, 0.1 M NA ACETATE AND 20% PEG4000 PH5.15, pH 7 |
