5WD6
bovine salivary protein form 30b
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-02-27 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 81.650, 59.570, 89.940 |
| Unit cell angles | 90.00, 106.25, 90.00 |
Refinement procedure
| Resolution | 47.429 - 2.000 |
| R-factor | 0.2084 |
| Rwork | 0.205 |
| R-free | 0.25140 |
| Structure solution method | SAD |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.805 |
| Data reduction software | MOSFLM (7.2.1) |
| Data scaling software | SCALA |
| Phasing software | AutoSol |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.430 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.100 | 0.662 |
| Rpim | 0.040 | 0.245 |
| Number of reflections | 28136 | 4080 |
| <I/σ(I)> | 11.8 | |
| Completeness [%] | 99.9 | 100 |
| Redundancy | 7.2 | 7.3 |
| CC(1/2) | 0.998 | 0.922 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 291 | 0.1M HEPES pH 7.5, 0.2M CaCl2, 9% PEG 3350, 5% IPA |
