2XJS
X-ray structure of the N-terminal domain of the flocculin Flo5 from Saccharomyces cerevisiae in complex with calcium and a1,2-mannobiose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-05-07 |
| Detector | ADSC QUANTUM 4 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 46.450, 61.960, 106.530 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.440 - 1.300 |
| R-factor | 0.12344 |
| Rwork | 0.123 |
| R-free | 0.15209 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | UNPUBLISHED STRUCTURAL DATA |
| RMSD bond length | 0.012 |
| RMSD bond angle | 2.200 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.440 | 1.300 |
| High resolution limit [Å] | 1.240 | 1.240 |
| Rmerge | 0.040 | 0.440 |
| Number of reflections | 85499 | |
| <I/σ(I)> | 20.5 | 2.9 |
| Completeness [%] | 93.7 | 72.4 |
| Redundancy | 3.6 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.5 M NACL, 100 MM BISTRIS-PROPANE PH 7.5, 20% PEG 4000 |
