5TUJ
Ancestral Cationic Amino Acid Solute Binding Protein (AncCDT-1)
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 | 2016-03-11 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 71.641, 71.641, 124.001 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 27.743 - 3.352 |
| R-factor | 0.3066 |
| Rwork | 0.305 |
| R-free | 0.33750 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.584 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.820 | 3.620 |
| High resolution limit [Å] | 3.350 | 3.350 |
| Rmerge | 0.215 | 1.001 |
| Number of reflections | 5646 | |
| <I/σ(I)> | 8 | 1.9 |
| Completeness [%] | 99.8 | 99.8 |
| Redundancy | 9.5 | 7.8 |
| CC(1/2) | 0.994 | 0.744 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8 | 291 | 0.2 M Lithium sulfate 0.1 M Tris 22.5 % PEG3350 |
