5VCQ
A Hyrdrogen Producing Hybrid Streptavidin-Diiron Catalyst
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.2.2 |
Synchrotron site | ALS |
Beamline | 8.2.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-09-15 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 1.0 |
Spacegroup name | P 65 |
Unit cell lengths | 56.849, 56.849, 239.611 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 49.233 - 2.051 |
R-factor | 0.1689 |
Rwork | 0.165 |
R-free | 0.21840 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 1.307 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX (1.9_1692) |
Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 50.000 |
High resolution limit [Å] | 2.050 |
Rmerge | 0.126 |
Number of reflections | 54193 |
<I/σ(I)> | 22.875 |
Completeness [%] | 99.6 |
Redundancy | 5.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 298 | 100mM TRIS pH 8.5, 200mM MgCl2, 20-30% PEG4000 |