4LE8
Structure of the Als3 adhesin from Candida albicans, residues 1-299 (mature sequence)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2011-12-04 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97630 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 140.630, 30.890, 143.190 |
| Unit cell angles | 90.00, 91.86, 90.00 |
Refinement procedure
| Resolution | 71.560 - 1.750 |
| R-factor | 0.25843 |
| Rwork | 0.257 |
| R-free | 0.29068 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2y7n |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.437 |
| Data reduction software | XDS |
| Data scaling software | SC |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 71.560 | 1.850 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.095 | 0.391 |
| Number of reflections | 55086 | |
| <I/σ(I)> | 8.4 | 2.7 |
| Completeness [%] | 95.5 | 87.9 |
| Redundancy | 3.5 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 4 | 293.15 | 1.0 M lithium chloride, 0.1 M sodium citrate, pH 4.0, 20% w/v PEG6000, VAPOR DIFFUSION, temperature 293.15K |
