5Z21
The ternary structure of D-lactate dehydrogenase from Fusobacterium nucleatum with NADH and oxamate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
Synchrotron site | Photon Factory |
Beamline | AR-NW12A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-12-17 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.97911 |
Spacegroup name | P 21 21 2 |
Unit cell lengths | 117.230, 159.740, 90.000 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.010 - 2.300 |
R-factor | 0.22679 |
Rwork | 0.225 |
R-free | 0.25142 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1j49 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.629 |
Data scaling software | SCALA |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 42.010 | 2.420 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.125 | 0.640 |
Rpim | 0.050 | 0.254 |
Number of reflections | 75787 | 10924 |
<I/σ(I)> | 13.5 | 3.2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7.2 | 7.3 |
CC(1/2) | 0.996 | 0.738 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | 2 mM NADH, 25 mM oxamate, 100 mM acetate buffer pH 5, 4% PEG 4000 |