3S2F
Crystal Structure of FurX NADH:Furfural
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.1 |
| Synchrotron site | ALS |
| Beamline | 8.2.1 |
| Spacegroup name | P 1 |
| Unit cell lengths | 68.271, 92.854, 117.690 |
| Unit cell angles | 106.08, 89.97, 89.98 |
Refinement procedure
| Resolution | 45.984 - 2.000 |
| R-factor | 0.1821 |
| Rwork | 0.182 |
| R-free | 0.21380 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.954 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Refinement software | PHENIX (1.6.1_357) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 46.000 |
| High resolution limit [Å] | 1.880 |
| Number of reflections | 166925 |
| Completeness [%] | 89.0 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
