4CR6
Crystal structure of the N-acetyl-D-mannosamine dehydrogenase without substrates
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-2 |
Synchrotron site | ESRF |
Beamline | ID23-2 |
Temperature [K] | 294 |
Detector technology | CCD |
Collection date | 2011-05-05 |
Detector | MARMOSAIC 225 mm CCD |
Spacegroup name | P 1 |
Unit cell lengths | 59.255, 59.062, 74.206 |
Unit cell angles | 81.13, 73.29, 79.25 |
Refinement procedure
Resolution | 12.000 - 1.900 |
R-factor | 0.20966 |
Rwork | 0.209 |
R-free | 0.22844 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2d1y |
RMSD bond length | 0.015 |
RMSD bond angle | 1.347 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 12.000 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.060 | 0.170 |
Number of reflections | 63579 | |
<I/σ(I)> | 6.2 | 3.9 |
Completeness [%] | 90.5 | 92.7 |
Redundancy | 1.9 | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 8 | 0.1 M HEPES, PH 7.5 AND 30% (W/V) PEG [POLY(ETHYLENE GLYCOL)] 300 |