3EMV
Crystal structure of Plasmodium vivax PNP with sulphate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX10.1 |
| Synchrotron site | SRS |
| Beamline | PX10.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-07-24 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0745 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 94.749, 94.749, 121.254 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 33.980 - 1.850 |
| R-factor | 0.19471 |
| Rwork | 0.193 |
| R-free | 0.23277 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2b94 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.611 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 67.880 | 1.920 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Rmerge | 0.095 | 0.234 |
| Number of reflections | 14619 | |
| <I/σ(I)> | 17.6 | 4.3 |
| Completeness [%] | 80.5 | 49 |
| Redundancy | 6 | 4.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 291 | 18% PEG 4000, 0.2M LiSO4, 0.1M Tris-HCl, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 291.0K |
