4J0D
tannin acyl hydrolase from Lactobacillus plantarum (Cadmium)
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 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.9184 |
| Spacegroup name | P 1 |
| Unit cell lengths | 46.940, 62.918, 84.070 |
| Unit cell angles | 70.58, 85.70, 78.96 |
Refinement procedure
| Resolution | 20.018 - 1.600 |
| R-factor | 0.144 |
| Rwork | 0.143 |
| R-free | 0.17470 |
| Structure solution method | MIR |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.596 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | SOLVE |
| Refinement software | PHENIX ((phenix.refine: 1.7.1_743)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 1.690 | |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.059 | |
| Number of reflections | 109375 | |
| <I/σ(I)> | 2.9 | |
| Completeness [%] | 93.1 | 72.9 |
| Redundancy | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 281 | 0.1M tri-sodium citrate pH 5.5, 20% PEG 3000, VAPOR DIFFUSION, SITTING DROP, temperature 281K |
