6O7P
Nitrogenase MoFeP mutant F99Y from Azotobacter vinelandii in the dithionite reduced state
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL9-2 |
Synchrotron site | SSRL |
Beamline | BL9-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-29 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9537 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 76.847, 128.439, 107.707 |
Unit cell angles | 90.00, 109.06, 90.00 |
Refinement procedure
Resolution | 46.652 - 1.700 |
R-factor | 0.1711 |
Rwork | 0.168 |
R-free | 0.20130 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2min |
RMSD bond length | 0.007 |
RMSD bond angle | 0.994 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 63.230 | 1.730 |
High resolution limit [Å] | 1.700 | 1.700 |
Rmerge | 0.237 | 1.442 |
Rmeas | 0.284 | 1.729 |
Rpim | 0.154 | 0.937 |
Number of reflections | 189177 | 10279 |
<I/σ(I)> | 6.4 | 1.5 |
Completeness [%] | 87.5 | 96.6 |
Redundancy | 6.4 | 6.2 |
CC(1/2) | 0.987 | 0.271 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.3 | 293 | 22% PEG 8000, 100 mM Tris pH 8.3, 500 mM NaCl, 10 mM dithionite |