4ZLE
Cellobionic acid phosphorylase - ligand free structure
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PHOTON FACTORY BEAMLINE BL-17A |
Synchrotron site | Photon Factory |
Beamline | BL-17A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-05-12 |
Detector | ADSC QUANTUM 270 |
Wavelength(s) | 0.9988 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 106.934, 106.934, 185.345 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 41.440 - 2.100 |
R-factor | 0.17258 |
Rwork | 0.170 |
R-free | 0.21936 |
Structure solution method | SAD |
RMSD bond length | 0.020 |
RMSD bond angle | 1.917 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | REFMAC (5.8.0107) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.140 |
High resolution limit [Å] | 2.100 | 2.100 |
Rmerge | 0.730 | |
Number of reflections | 72225 | |
<I/σ(I)> | 17.6 | 2.6 |
Completeness [%] | 99.5 | 100 |
Redundancy | 7.3 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | sodium citrate, Li2SO4, 0.6 M (NH3)2SO4, glycerol |