8QBZ
Crystal structure of the outer membrane decaheme cytochrome MtrC (E344Boc-Lys)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I24 |
Synchrotron site | Diamond |
Beamline | I24 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2022-05-20 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.7085 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 52.967, 89.664, 153.545 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.120 - 1.900 |
R-factor | 0.17586 |
Rwork | 0.174 |
R-free | 0.21577 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 2.671 |
Data reduction software | xia2 |
Data scaling software | xia2 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 89.660 | 1.930 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.451 | 1.390 |
Rmeas | 0.476 | 1.465 |
Rpim | 0.150 | 0.457 |
Total number of observations | 659243 | 28551 |
Number of reflections | 58591 | 2661 |
<I/σ(I)> | 5.3 | 1.2 |
Completeness [%] | 99.7 | |
Redundancy | 11.3 | 10.7 |
CC(1/2) | 0.920 | 0.483 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5 | 277 | 21% PEG 6000, 0.1 M CaCl2, 0.2 M Sodium acetate, pH 5.0 |