3VCO
Schistosoma mansoni Dihydrofolate reductase
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 | 2010-09-09 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.97627 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 107.352, 107.352, 33.458 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.009 - 1.946 |
| R-factor | 0.2031 |
| Rwork | 0.201 |
| R-free | 0.25040 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 8dfr |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.521 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.7.2_869) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 48.024 | 2.096 |
| High resolution limit [Å] | 1.946 | 3.328 | 1.946 |
| Number of reflections | 14759 | ||
| Completeness [%] | 99.0 | 99.7 | 99.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 291 | 100mM Hepes pH 8.0, 2.0M Ammonium sulphate, 12mg/mL DHFR., VAPOR DIFFUSION, HANGING DROP, temperature 291K |
