5G5I
S. enterica HisA mutant D10G
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-03-07 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 85.880, 85.880, 121.350 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.015 - 2.001 |
| R-factor | 0.1728 |
| Rwork | 0.171 |
| R-free | 0.21000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5g1t |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.073 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.120 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.120 | 0.830 |
| Number of reflections | 18463 | |
| <I/σ(I)> | 17.82 | 3.35 |
| Completeness [%] | 99.9 | 99.4 |
| Redundancy | 11.7 | 11.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | 0.1M HEPES, PH7.5; 0.8M SODIUM DIHYDROGEN PHOSPHATE; 0.8M POTASSIUM DIHYDROGEN PHOSPHATE |
