1UBK
Three-dimensional Structure of The Carbon Monoxide Complex of [NiFe]hydrogenase From Desulufovibrio vulgaris Miyazaki F
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL44B2 |
| Synchrotron site | SPring-8 |
| Beamline | BL44B2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2000-03-17 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.700 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 97.600, 125.260, 66.420 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.200 * |
| R-factor | 0.117 * |
| Rwork | 0.110 |
| R-free | 0.15100 * |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 1h2r |
| RMSD bond length | 0.015 |
| RMSD bond angle | 0.071 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.455 | 1.250 |
| High resolution limit [Å] | 1.180 | 1.180 |
| Rmerge | 0.055 | 0.339 |
| Number of reflections | 230808 | |
| Completeness [%] | 87.6 | 68.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.4 | 283 | MPD, pH 7.4, VAPOR DIFFUSION, SITTING DROP, temperature 283K |
