1QFZ
PEA FNR Y308S MUTANT IN COMPLEX WITH NADPH
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F1 |
| Synchrotron site | CHESS |
| Beamline | F1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 1998-02-01 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.360, 110.090, 80.920 |
| Unit cell angles | 90.00, 93.92, 90.00 |
Refinement procedure
| Resolution | 8.000 - 1.700 |
| R-factor | 0.201 * |
| Rwork | 0.201 |
| R-free | 0.23500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | Y308S:NADP+ |
| RMSD bond length | 0.019 |
| RMSD bond angle | 1.900 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | AMoRE |
| Refinement software | X-PLOR (3.8) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.790 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.058 * | 0.334 * |
| Total number of observations | 357117 * | |
| Number of reflections | 92562 | |
| <I/σ(I)> | 9 | 2.4 |
| Completeness [%] | 96.1 | 90.6 |
| Redundancy | 3.9 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 8 | 25 * | pH 8.0 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 4.5 (mg/ml) | |
| 2 | 1 | drop | potassium phosphate | 5 (mM) | |
| 3 | 1 | reservoir | ammonium sulfate | 2.1 (M) | |
| 4 | 1 | reservoir | Tris-HCl | 0.1 (M) |
