8POL
Crystal structure of Plasmodium falciparum Sub1 protease
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-06-18 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0717 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 86.576, 107.163, 137.682 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.250 - 3.090 |
| R-factor | 0.173 |
| Rwork | 0.170 |
| R-free | 0.22840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.698 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.300 | 3.300 |
| High resolution limit [Å] | 3.090 | 3.090 |
| Rpim | 0.060 | 0.317 |
| Number of reflections | 24055 | 4147 |
| <I/σ(I)> | 11.1 | 2.4 |
| Completeness [%] | 99.2 | 96.2 |
| Redundancy | 3.9 | 3.9 |
| CC(1/2) | 0.996 | 0.837 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.2 | 291 | 1.6 M NaH2PO4 / 0.4 M K2HPO4, 0.1 M phosphate-citrate, pH 5.2 |
