6FPO
High resolution structure of native Hydrogenase (Hyd-1)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-07-01 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.7749 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 93.786, 97.733, 183.102 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 91.550 - 1.050 |
| R-factor | 0.116 |
| Rwork | 0.115 |
| R-free | 0.13400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4usc |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.844 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 99.550 | 1.070 |
| High resolution limit [Å] | 1.050 | 1.050 |
| Rmerge | 0.117 | 2.210 |
| Number of reflections | 773665 | |
| <I/σ(I)> | 11.3 | 1.4 |
| Completeness [%] | 99.8 | 99.2 |
| Redundancy | 13.1 | 11.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.1 | 293 | 100 mM tris pH 8.1 200 mM LiSO4 150 mM NaCl 20-22% PEG 3350 |
