5WL7
Crystal structure of chalcone isomerase engineered from ancestral inference (ancCHI*)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-06-25 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 50.440, 65.440, 94.140 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.070 - 1.900 |
| R-factor | 0.178 |
| Rwork | 0.175 |
| R-free | 0.20620 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.277 |
| Data reduction software | iMOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 47.070 |
| High resolution limit [Å] | 1.900 |
| Number of reflections | 25236 |
| <I/σ(I)> | 11.04 |
| Completeness [%] | 100.0 |
| Redundancy | 6.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 277 | 4.5M NaCl, 50mM acetic acid |
