8QC9

Crystal structure of the outer membrane decaheme cytochrome MtrC (A293Boc-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	2023-05-11
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.9537
Spacegroup name	P 21 21 21
Unit cell lengths	53.078, 90.021, 154.522
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	58.630 - 2.000
R-factor	0.1752
Rwork	0.173
R-free	0.21430
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.096
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	58.630	2.050
High resolution limit [Å]	2.000	2.000
Rmerge	0.346
Number of reflections	50997	3730
<I/σ(I)>	6.1
Completeness [%]	100.0	100
Redundancy	13.4	13.9
CC(1/2)	0.991	0.602

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	277	200 mM Na acetate pH 5.0, 100 mM CaCl2 and 21% PEG 6000