5NFR
Crystal structure of malate dehydrogenase from Plasmodium falciparum (PfMDH)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-02-10 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.97841 |
| Spacegroup name | P 1 |
| Unit cell lengths | 72.018, 152.689, 158.393 |
| Unit cell angles | 103.77, 101.46, 94.93 |
Refinement procedure
| Resolution | 47.600 - 2.400 |
| R-factor | 0.2489 |
| Rwork | 0.248 |
| R-free | 0.26423 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2hjr |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.734 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0124) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.620 | 2.380 |
| High resolution limit [Å] | 2.240 | 2.240 |
| Rmerge | 0.053 | 0.456 |
| Number of reflections | 273174 | 31701 |
| <I/σ(I)> | 10.46 | 1.57 |
| Completeness [%] | 89.5 | 64.3 |
| Redundancy | 2.12 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.22 | 293 | 100 mM Ammonium citrate pH 7.22 22% (w/v) PEG 3350 |
