6WEE

Copper-bound M88I variant of Campylobacter jejuni P19

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	CCD
Collection date	2018-09-19
Detector	RIGAKU SATURN 944+
Wavelength(s)	1.5418
Spacegroup name	P 62
Unit cell lengths	132.965, 132.965, 104.878
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.552 - 2.300
R-factor	0.2373
Rwork	0.235
R-free	0.27740
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3lzl
Data reduction software	DENZO
Data scaling software	HKL-3000
Phasing software	PHASER (2.8.1)
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.340
High resolution limit [Å]	2.300	6.240	2.300
Rmerge	0.104	0.034	0.833
Rmeas	0.109	0.036	0.889
Rpim	0.033	0.011	0.300
Total number of observations	490946
Number of reflections	45682	2391	1809
<I/σ(I)>	5.8
Completeness [%]	97.5	99	77.8
Redundancy	10.7	10.9	7.6
CC(1/2)		1.000	0.815

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	298	2.4 M ammonium sulfate, 0.2 M lithium sulfate and 0.1 M Tris pH 7