8QBQ
Crystal structure of the outer membrane decaheme cytochrome MtrC (A430Boc-Lys)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-01-29 |
Detector | DECTRIS EIGER2 XE 16M |
Wavelength(s) | 0.9537 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 52.904, 89.609, 154.031 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 44.800 - 1.810 |
R-factor | 0.1564 |
Rwork | 0.155 |
R-free | 0.18660 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 1.057 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 58.400 | 1.580 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.134 | 1.360 |
Rmeas | 0.140 | 1.557 |
Rpim | 0.039 | 0.737 |
Total number of observations | 1078151 | 10966 |
Number of reflections | 95747 | 2787 |
<I/σ(I)> | 10.3 | 0.4 |
Completeness [%] | 89.6 | |
Redundancy | 11.3 | 3.9 |
CC(1/2) | 0.998 | 0.355 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.2 M Na Acetate pH 5.0, 100 mM CaCl2 and 21% PEG 6000 |