4YBF
Aspartic Proteinase Sapp2 Secreted from Candida Parapsilosis at 1.25 A Resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.2 |
| Synchrotron site | BESSY |
| Beamline | 14.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-01-06 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.915 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 49.138, 57.147, 54.553 |
| Unit cell angles | 90.00, 90.61, 90.00 |
Refinement procedure
| Resolution | 39.460 - 1.240 |
| R-factor | 0.1482 |
| Rwork | 0.147 |
| R-free | 0.17450 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3fv3 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.615 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.310 | |
| High resolution limit [Å] | 1.240 | 3.700 | 1.240 |
| Rmerge | 0.062 | 0.050 | 0.521 |
| Rmeas | 0.068 | 0.054 | 0.569 |
| Total number of observations | 554808 | ||
| Number of reflections | 84475 | 3300 | 13193 |
| <I/σ(I)> | 14.85 | 33.88 | 3.4 |
| Completeness [%] | 98.3 | 99.1 | 95.5 |
| Redundancy | 6.5 | 6.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | PEG 400 |
