5ZVU
Crystal structure of K132A mutant of phosphomannose isomerase from Salmonella typhimurium
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-07-08 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.95372 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 36.140, 91.790, 111.690 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.230 - 2.200 |
R-factor | 0.21564 |
Rwork | 0.213 |
R-free | 0.27262 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3h1m |
RMSD bond length | 0.013 |
RMSD bond angle | 1.636 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.230 | 2.320 |
High resolution limit [Å] | 2.200 | 2.200 |
Number of reflections | 20172 | |
<I/σ(I)> | 9.4 | |
Completeness [%] | 100.0 | |
Redundancy | 7.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 6.8 | 298 | 0.1 M Magnesium acetate tetrahydrate, 0.2 M Sodium cacodylate pH 6.8, 20% PEG 8000,25% dioxane |