3NI8
Crystal Structure of PFC0360w, an HSP90 activator from plasmodium falciparum
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E+ SUPERBRIGHT |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-05-20 |
Detector | RIGAKU SATURN A200 |
Wavelength(s) | 1.5418 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 96.658, 96.658, 44.288 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 32.700 - 2.500 |
R-factor | 0.226 |
Rwork | 0.224 |
R-free | 0.26100 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.012 |
RMSD bond angle | 1.392 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.700 | 2.540 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.159 | 0.836 |
Number of reflections | 8517 | |
<I/σ(I)> | 2.8 | 1.42 |
Completeness [%] | 99.9 | 98.6 |
Redundancy | 10.6 | 9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.6 | 293 | 20% isopropanol, 20% PEG 4000, 0.1M Na Citrate pH 5.6, VAPOR DIFFUSION, SITTING DROP, temperature 293K |