1WND
Escherichia coli YdcW gene product is a medium-chain aldehyde dehydrogenase as determined by kinetics and crystal structure
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-2 |
Synchrotron site | ESRF |
Beamline | ID14-2 |
Temperature [K] | 102 |
Detector technology | CCD |
Collection date | 2002-10-01 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 0.93 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 85.036, 79.680, 158.669 |
Unit cell angles | 90.00, 95.77, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.100 |
R-factor | 0.18588 |
Rwork | 0.184 |
R-free | 0.21309 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.015 |
RMSD bond angle | 1.490 |
Data reduction software | DENZO |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1.19) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.076 | 0.198 |
Number of reflections | 116969 | |
<I/σ(I)> | 7.1 | |
Completeness [%] | 96.3 | 96.3 |
Redundancy | 5.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 298 | PEG 4000, Imidazol malate, pH 6, VAPOR DIFFUSION, HANGING DROP, temperature 298K |