4UEQ
Structure of the V74C large subunit mutant of D. fructosovorans NiFe- hydrogenase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-11-05 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | P 1 |
| Unit cell lengths | 60.720, 99.800, 190.800 |
| Unit cell angles | 90.21, 98.61, 90.11 |
Refinement procedure
| Resolution | 20.000 - 1.700 |
| R-factor | 0.13905 |
| Rwork | 0.137 |
| R-free | 0.18539 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1yqw |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.421 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.800 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.050 | 0.360 |
| Number of reflections | 414223 | |
| <I/σ(I)> | 10.3 | 2.4 |
| Completeness [%] | 85.0 | 75.3 |
| Redundancy | 1.9 | 1.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.3 | INSIDE ANAEROBIC GLOVE BOX, PEG6000, MES, PH 7.3 |
