4XGB
Crystal Structure of E112A/H234A Mutant of Stationary Phase Survival Protein (SurE) from Salmonella typhimurium co-crystallized with AMP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2013-11-07 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54179 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 161.420, 96.520, 94.510 |
| Unit cell angles | 90.00, 99.34, 90.00 |
Refinement procedure
| Resolution | 59.380 - 2.230 |
| R-factor | 0.21097 |
| Rwork | 0.208 |
| R-free | 0.26248 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4xer |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.196 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.380 | 2.330 |
| High resolution limit [Å] | 2.210 | 2.210 |
| Rmerge | 0.356 | |
| Number of reflections | 67404 | |
| <I/σ(I)> | 6.3 | 2.6 |
| Completeness [%] | 94.6 | 75.6 |
| Redundancy | 2.6 | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 4.6 | 293 | 0.02M Calcium chloride, 0.1 M sodium acetate (pH 4.6) and 30 % 2 methyl 2,4 pentanediol |
