8FSS

Complex Structure of YejA-S481A with Microcin C7

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2017-07-12
Detector	RAYONIX MX300-HS
Wavelength(s)	0.97872
Spacegroup name	I 2 2 2
Unit cell lengths	90.089, 102.834, 144.381
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	76.550 - 2.000
R-factor	0.21924
Rwork	0.219
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.018
RMSD bond angle	1.862
Data reduction software	HKL-2000
Data scaling software	XDS
Phasing software	PHASER
Refinement software	REFMAC (5.8)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	77.000	2.080
High resolution limit [Å]	2.000	2.010
Number of reflections	76964	44755
<I/σ(I)>	30.4
Completeness [%]	99.1
Redundancy	8.4
CC(1/2)	0.997	0.911

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		282.15	90 mM BIS-TRIS pH 6.5, 15% (w/v) PEG MME 5000, and 0.5% (w/v) n-dodecyl-beta-D-maltoside