3IWK
Crystal structure of aminoaldehyde dehydrogenase 1 from Pisum sativum (PsAMADH1)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-01-29 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 86.410, 216.870, 205.760 |
| Unit cell angles | 90.00, 98.02, 90.00 |
Refinement procedure
| Resolution | 47.840 - 2.400 |
| R-factor | 0.20198 |
| Rwork | 0.200 |
| R-free | 0.24360 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1cw3 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.114 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0072) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.530 | |
| High resolution limit [Å] | 2.400 | 7.590 | 2.400 |
| Rmerge | 0.103 | 0.036 | 0.622 |
| Number of reflections | 290858 | 9316 | 42318 |
| <I/σ(I)> | 14.06 | 34.4 | 3.7 |
| Completeness [%] | 99.7 | 99.1 | 99.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.1M HEPES pH 7.5, 13% PEG 6000, 5% 2-methyl-2,4-pentanediol, 5mM NAD, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
