1KV9
Structure at 1.9 A Resolution of a Quinohemoprotein Alcohol Dehydrogenase from Pseudomonas putida HK5
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RU200 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 1997-07-15 |
| Detector | RIGAKU RAXIS |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 |
| Unit cell lengths | 54.807, 57.437, 67.523 |
| Unit cell angles | 89.65, 69.34, 68.39 |
Refinement procedure
| Resolution | 30.000 - 1.900 |
| Rwork | 0.154 |
| R-free | 0.18900 |
| Structure solution method | MR + MIR + MAD |
| Starting model (for MR) | 4aah |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.440 * |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE (+ SHARP) |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.064 | 0.215 |
| Number of reflections | 48672 | |
| <I/σ(I)> | 18.2 | 4.2 |
| Completeness [%] | 87.1 | 47.3 |
| Redundancy | 3.5 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 295 | used microseeding * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 7.5 (mg/ml) | |
| 2 | 1 | reservoir | PEG8000 | 14-22 (%) | |
| 3 | 1 | reservoir | sodium citrate | 150 (mM) | |
| 4 | 1 | reservoir | HEPES-NaOH | 100 (mM) | pH7.5 |
| 5 | 1 | reservoir | 2-propanol | 6 (%) |
