3LMU
Crystal structure of DTD from Plasmodium falciparum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2007-07-29 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.5418 |
Spacegroup name | P 43 |
Unit cell lengths | 77.180, 77.180, 214.520 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 33.958 - 3.300 |
R-factor | 0.189 |
Rwork | 0.185 |
R-free | 0.25600 |
Structure solution method | SAD |
RMSD bond length | 0.009 |
RMSD bond angle | 1.154 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | SOLVE |
Refinement software | PHENIX (1.5_2) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.420 |
High resolution limit [Å] | 3.300 | 3.300 |
Rmerge | 0.162 | 0.516 |
Number of reflections | 18914 | |
<I/σ(I)> | 6.8 | |
Completeness [%] | 100.0 | 100 |
Redundancy | 14.9 | 14.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 25% PEG1500, VAPOR DIFFUSION, HANGING DROP, temperature 293K |