2BSX
Crystal structure of the Plasmodium falciparum purine nucleoside phosphorylase complexed with inosine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-09-12 |
Detector | ADSC CCD |
Spacegroup name | P 3 2 1 |
Unit cell lengths | 95.117, 95.117, 47.075 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 18.900 - 2.000 |
R-factor | 0.268 |
Rwork | 0.264 |
R-free | 0.34200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lx7 |
RMSD bond length | 0.018 |
RMSD bond angle | 1.931 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.080 | 0.350 |
Number of reflections | 27984 | |
<I/σ(I)> | 10 | 5 |
Completeness [%] | 87.0 | 80 |
Redundancy | 2.5 | 2.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 10 % PEG 8000, 0.1 M HEPES PH 7.5, 30 % HEXANETRIOL |