5OIE
Crystal structure of Mycolicibacterium hassiacum glucosylglycerate hydrolase (MhGgH) E419A variant in complex with serine and glycerol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-1 |
Synchrotron site | ESRF |
Beamline | MASSIF-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-12-12 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.96600 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 86.187, 159.370, 88.345 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.781 - 2.071 |
R-factor | 0.169 |
Rwork | 0.167 |
R-free | 0.20780 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ohz |
RMSD bond length | 0.010 |
RMSD bond angle | 1.004 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.781 | 2.140 |
High resolution limit [Å] | 2.070 | 2.070 |
Rmerge | 0.094 | 1.032 |
Rmeas | 0.106 | 1.176 |
Rpim | 0.048 | 0.551 |
Number of reflections | 73877 | |
<I/σ(I)> | 10 | 1.3 |
Completeness [%] | 98.9 | 92.6 |
Redundancy | 4.6 | 4 |
CC(1/2) | 0.997 | 0.625 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | Tris-Bicine pH 8.5, amino acids, PEG 4000, glycerol |