6E17
A131E mutant of cyt P460 of Nitrosomonas sp. AL212 with NO bound
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-06 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.979 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 48.673, 80.045, 119.170 |
Unit cell angles | 90.00, 92.57, 90.00 |
Refinement procedure
Resolution | 48.624 - 1.970 |
R-factor | 0.2094 |
Rwork | 0.208 |
R-free | 0.23950 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6amg |
RMSD bond length | 0.016 |
RMSD bond angle | 1.002 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.10.1_2155)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.640 | 2.040 |
High resolution limit [Å] | 1.970 | 1.970 |
Rmerge | 0.043 | 0.120 |
Number of reflections | 63916 | 63916 |
<I/σ(I)> | 38.5 | |
Completeness [%] | 98.8 | |
Redundancy | 2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 293 | 0.2 M sodium chloride, 0.1Msodium acetate, and PEG 6000 |