3I0P
Crystal structure of malate dehydrogenase from Entamoeba histolytica
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Collection date | 2009-05-06 |
Wavelength(s) | 0.97946 |
Spacegroup name | P 3 2 1 |
Unit cell lengths | 106.230, 106.230, 72.114 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 38.780 - 2.600 |
R-factor | 0.184 |
Rwork | 0.182 |
R-free | 0.23200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1v9n |
RMSD bond length | 0.009 |
RMSD bond angle | 1.208 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 38.780 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.144 | 0.536 |
Number of reflections | 14659 | |
<I/σ(I)> | 13.75 | 2.18 |
Completeness [%] | 99.1 | 94.7 |
Redundancy | 7.5 | 5.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 289 | JCSG+ sparse matrix screen condition a2, 20% PEG 3000, 0.1 M Na Citrate pH 5.5, 25% glycerol as cryo-protectant, 30 mg/mL protein, crystal ID 203003a2, VAPOR DIFFUSION, SITTING DROP, temperature 289K |