5XVD
[NiFe]-hydrogenase (Hyb-type) from Citrobacter sp. S-77 in an air-oxidized condition
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL44XU |
Synchrotron site | SPring-8 |
Beamline | BL44XU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-09-24 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.90000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 63.940, 118.980, 96.810 |
Unit cell angles | 90.00, 100.57, 90.00 |
Refinement procedure
Resolution | 31.722 - 1.570 |
R-factor | 0.1234 |
Rwork | 0.121 |
R-free | 0.16580 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.314 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 1.570 |
Number of reflections | 382238 |
<I/σ(I)> | 7.3 |
Completeness [%] | 97.5 |
Redundancy | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 283 | 0.1M Tris, 18% PEG 10000, 100mM Sodium Chloride, 20% glycerol |