5ZED
Crystal structure of Kluyveromyces polyspora ADH (KpADH) mutant (E214V/T215S)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-11-10 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97778 |
Spacegroup name | P 61 |
Unit cell lengths | 102.448, 102.448, 133.896 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 47.842 - 2.199 |
R-factor | 0.172 |
Rwork | 0.170 |
R-free | 0.21500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5z2x |
RMSD bond length | 0.008 |
RMSD bond angle | 1.075 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.842 | 2.200 |
High resolution limit [Å] | 2.199 | 2.199 |
Rmerge | 0.167 | 0.512 |
Number of reflections | 39934 | |
<I/σ(I)> | 14.73 | |
Completeness [%] | 90.7 | |
Redundancy | 5.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291 | ammonium acetate, HEPES, 31% PEG 3350 |