5IUV
Crystal Structure of Indole-3-acetaldehyde Dehydrogenase in complexed with NAD+
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 | 2015-07-10 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.979 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 80.677, 84.747, 166.822 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 37.778 - 1.928 |
R-factor | 0.1471 |
Rwork | 0.146 |
R-free | 0.18100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4mpb |
RMSD bond length | 0.005 |
RMSD bond angle | 0.985 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 37.780 | 1.960 |
High resolution limit [Å] | 1.928 | 1.930 |
Number of reflections | 85788 | |
<I/σ(I)> | 14 | 2.53 |
Completeness [%] | 99.9 | 99.9 |
Redundancy | 5.2 | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 277 | 8% PEG8000, 100 mM Tris |