1WUH
Three-Dimensional Structure Of The Ni-A State 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 | 2002-05-24 |
Detector | MARRESEARCH |
Wavelength(s) | 0.7000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 98.227, 126.261, 66.440 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 16.410 - 1.240 |
R-factor | 0.113 |
Rwork | 0.110 |
R-free | 0.15700 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.013 |
RMSD bond angle | 0.032 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | CNS |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.310 |
High resolution limit [Å] | 1.240 | 1.240 |
Rmerge | 0.081 | 0.438 |
Number of reflections | 226089 | |
Completeness [%] | 97.2 | 96.4 |
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 |