1V0P
Structure of P. falciparum PfPK5-Purvalanol B ligand complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 222.640, 44.361, 63.762 |
| Unit cell angles | 90.00, 103.19, 90.00 |
Refinement procedure
| Resolution | 105.410 - 2.000 |
| R-factor | 0.198 |
| Rwork | 0.194 |
| R-free | 0.26500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.021 |
| RMSD bond angle | 1.820 |
| Refinement software | REFMAC (5.1.19) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 27.000 |
| High resolution limit [Å] | 2.000 |
| Rmerge | 0.093 |
| Number of reflections | 38513 |
| <I/σ(I)> | 4.4 |
| Completeness [%] | 93.1 |
| Redundancy | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.4 | pH 7.40 |
