4M1Q
Crystal structure of L-lactate dehydrogenase from Bacillus selenitireducens MLS10, NYSGRC Target 029814.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-07-18 |
Detector | RAYONIX MX225HE |
Wavelength(s) | 0.9791 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 81.878, 81.878, 210.268 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.390 - 1.600 |
R-factor | 0.1812 |
Rwork | 0.180 |
R-free | 0.19600 |
Structure solution method | SAD |
RMSD bond length | 0.008 |
RMSD bond angle | 1.311 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | SHELXS |
Refinement software | REFMAC |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 1.630 |
High resolution limit [Å] | 1.600 | 4.340 | 1.600 |
Rmerge | 0.104 | 0.061 | 0.937 |
Number of reflections | 108623 | ||
<I/σ(I)> | 9.2 | ||
Completeness [%] | 99.9 | 99.5 | 100 |
Redundancy | 6.8 | 7.3 | 7.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.2 | 298 | 0.1 M Na2HPO4/KH2PO4, pH 6.2, 35% MPD, VAPOR DIFFUSION, SITTING DROP, temperature 298K |