4GKV
Structure of Escherichia coli AdhP (ethanol-inducible dehydrogenase) with bound NAD
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH3R |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2011-08-01 |
| Detector | RIGAKU RAXIS IV++ |
| Wavelength(s) | 1.54178 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 68.160, 118.920, 97.870 |
| Unit cell angles | 90.00, 106.41, 90.00 |
Refinement procedure
| Resolution | 32.690 - 2.008 |
| R-factor | 0.1399 |
| Rwork | 0.138 |
| R-free | 0.18370 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.132 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((phenix.refine: 1.8_1069)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.000 | 2.120 |
| High resolution limit [Å] | 2.010 | 2.010 |
| Rmerge | 0.066 | 0.247 |
| Number of reflections | 99140 | |
| <I/σ(I)> | 11.7 | 4.7 |
| Completeness [%] | 99.5 | 98.7 |
| Redundancy | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 290 | 20% PEG 3350, 10mM NAD, 0.2M Sodium Sulfate, 0.1M Bis Tris Propane , pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 290K |
