4WB9
Human ALDH1A1 complexed with NADH
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 19-ID |
Synchrotron site | APS |
Beamline | 19-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-08-04 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.98 |
Spacegroup name | P 4 2 2 |
Unit cell lengths | 109.415, 109.415, 83.448 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 109.420 - 2.070 |
R-factor | 0.17689 |
Rwork | 0.174 |
R-free | 0.23387 |
RMSD bond length | 0.020 |
RMSD bond angle | 1.767 |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 109.420 | 2.110 |
High resolution limit [Å] | 2.070 | 2.070 |
Rmerge | 0.091 | 0.520 |
<I/σ(I)> | 17.8 | 4.9 |
Completeness [%] | 99.0 | 100 |
Redundancy | 8.3 | 7.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | EVAPORATION | 7 | 300 | PEG3350, sodium chloride, 100mM BisTris Buffer, ytterbium chloride, NAD, sitting drop |