3MAV
Crystal structure of Plasmodium vivax putative farnesyl pyrophosphate synthase (Pv092040)
Replaces: 2IHIExperimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2006-09-12 |
Detector | RIGAKU RAXIS IV++ |
Wavelength(s) | 1.54 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 83.969, 116.390, 92.416 |
Unit cell angles | 90.00, 116.01, 90.00 |
Refinement procedure
Resolution | 20.990 - 2.100 |
R-factor | 0.2291 |
Rwork | 0.229 |
R-free | 0.26150 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1yhk |
RMSD bond length | 0.011 |
RMSD bond angle | 0.920 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | BUSTER (2.8.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.140 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.054 | 0.564 |
Number of reflections | 92263 | |
<I/σ(I)> | 17.5 | 2.53 |
Completeness [%] | 99.1 | 96.6 |
Redundancy | 4.7 | 4.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 297 | 22% PEG 3350, 200 MM LI2SO4, 100 MM TRIS pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 297K |