3KO9
DTD from Plasmodium falciparum in complex with D-Arginine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2008-10-13 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 52.252, 54.863, 92.419 |
| Unit cell angles | 106.94, 101.63, 94.49 |
Refinement procedure
| Resolution | 30.000 - 2.750 |
| R-factor | 0.205 |
| Rwork | 0.201 |
| R-free | 0.27500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | PfDTD-Iodide model (not deposited) |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.282 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.850 |
| High resolution limit [Å] | 2.750 | 2.750 |
| Rmerge | 0.053 | 0.521 |
| Number of reflections | 24028 | |
| <I/σ(I)> | 14.1 | |
| Completeness [%] | 97.3 | 94.3 |
| Redundancy | 3.9 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 25% PEG 1500, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
