4PY6
Crystal Structure of bromodomain of PFA0510w from Plasmodium Falciparum
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-02-28 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | .97949 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 74.324, 84.269, 219.724 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.410 - 2.500 |
| R-factor | 0.2387 |
| Rwork | 0.237 |
| R-free | 0.26810 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.970 |
| Data scaling software | Aimless (0.2.17) |
| Phasing software | PHASER |
| Refinement software | BUSTER-TNT |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 29.410 | 29.410 | 2.410 |
| High resolution limit [Å] | 2.330 | 9.020 | 2.330 |
| Rmerge | 0.164 | 0.060 | 0.561 |
| Total number of observations | 3126 | 16604 | |
| Number of reflections | 29757 | ||
| <I/σ(I)> | 8.6 | 19.7 | 2.5 |
| Completeness [%] | 99.2 | 96.6 | 93.5 |
| Redundancy | 6.1 | 5.5 | 6.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 277 | 0.1 M Tris, 0.1 M CaCl2, 20% PEG6k, 15% ethylene glycol, VAPOR DIFFUSION, SITTING DROP, temperature 277K, pH 8.5 |
