7XRN
Ethanolamine ammonia-lyase complexed with AdoMeCbl in the presence of substrate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B2 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-02-14 |
| Detector | RAYONIX MX225HE |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 63 |
| Unit cell lengths | 242.383, 242.383, 76.586 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.160 - 2.070 |
| R-factor | 0.216 |
| Rwork | 0.214 |
| R-free | 0.24100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3abr |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.856 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.000 | 2.120 |
| High resolution limit [Å] | 2.070 | 2.070 |
| Rmerge | 0.075 | 0.583 |
| Number of reflections | 156031 | 156031 |
| <I/σ(I)> | 19.77 | 2.07 |
| Completeness [%] | 99.9 | 98.8 |
| Redundancy | 6.82 | 3.45 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 277 | 10% (w/v) PEG 6000, 0.1 M Ammonium chloride, and 0.05 M HEPES pH 7.0 |
