7XRM
Ethanolamine ammonia-lyase complexed with AdoMeCbl
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-02-10 |
Detector | RAYONIX MX300HE |
Wavelength(s) | 0.9000 |
Spacegroup name | P 63 |
Unit cell lengths | 242.885, 242.885, 76.638 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.420 - 2.130 |
R-factor | 0.1962 |
Rwork | 0.194 |
R-free | 0.21980 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3abr |
RMSD bond length | 0.003 |
RMSD bond angle | 0.887 |
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] | 47.000 | 2.190 |
High resolution limit [Å] | 2.130 | 2.130 |
Rmerge | 0.123 | 1.173 |
Rmeas | 0.132 | 1.258 |
Number of reflections | 143007 | 10603 |
<I/σ(I)> | 14.95 | |
Completeness [%] | 99.2 | 99.8 |
Redundancy | 7.71 | 7.64 |
CC(1/2) | 0.998 | 0.479 |
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 |