5YSN
Ethanolamine ammonia-lyase, AdoCbl/substrate-free
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 | 242.723, 242.723, 76.573 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 48.000 - 2.001 |
R-factor | 0.1649 |
Rwork | 0.163 |
R-free | 0.19170 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3abr |
RMSD bond length | 0.009 |
RMSD bond angle | 1.240 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.000 | 2.030 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.102 | 0.574 |
Rmeas | 0.110 | 0.643 |
Number of reflections | 172666 | 8189 |
<I/σ(I)> | 21.6 | 2.79 |
Completeness [%] | 99.7 | 95.1 |
Redundancy | 7.3 | 4.8 |
CC(1/2) | 0.997 | 0.590 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 9 | 277 | 12.5% (w/v) PEG 1500, 0.05M sodium malonate, imidazole, boric acid (MIB) buffer pH 9.0 |