8CP0
Structure of the catalytic domain of P. vivax Sub1 (trigonal crystal form)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-07-26 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 89.150, 89.150, 119.078 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 47.150 - 3.251 |
| R-factor | 0.1981 |
| Rwork | 0.196 |
| R-free | 0.24150 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.880 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | BUSTER |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.150 | 3.510 |
| High resolution limit [Å] | 3.250 | 3.250 |
| Rpim | 0.107 | 0.264 |
| Number of reflections | 8758 | 1784 |
| <I/σ(I)> | 6.9 | |
| Completeness [%] | 98.0 | 98.7 |
| Redundancy | 5.6 | 5.5 |
| CC(1/2) | 0.980 | 0.920 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.1 M MES, 0.2 M MgCl2, 25% W/V PEG4000, pH 6.5 |
