4UCW
Structure of the T18V small subunit mutant of D. fructosovorans NiFe- hydrogenase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 293 |
| Detector technology | CCD |
| Collection date | 2009-07-02 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.200, 99.590, 181.840 |
| Unit cell angles | 90.00, 92.47, 90.00 |
Refinement procedure
| Resolution | 25.000 - 2.300 |
| R-factor | 0.19398 |
| Rwork | 0.192 |
| R-free | 0.23552 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1yqw |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.474 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0071) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.350 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.070 | 0.260 |
| Number of reflections | 92096 | |
| <I/σ(I)> | 13.5 | 3.88 |
| Completeness [%] | 93.5 | 67.9 |
| Redundancy | 3.2 | 2.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6 | 293 | VAPOR DIFFUSION, PH 6.0, 293K, PEG 6000, MES, INSIDE A GLOVEBOX |
