8IPJ

Crystal structure of the Legionella effector protein MavL with ADPR-Ub

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NFPSS BEAMLINE BL18U
Synchrotron site	NFPSS
Beamline	BL18U
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-05-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.979
Spacegroup name	C 1 2 1
Unit cell lengths	80.958, 68.185, 85.556
Unit cell angles	90.00, 100.55, 90.00

Refinement procedure

Resolution	46.645 - 2.003
R-factor	0.1865
Rwork	0.184
R-free	0.22220
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6omi
RMSD bond length	0.007
RMSD bond angle	0.838
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.646	2.000
High resolution limit [Å]	1.900	1.930
Rmerge	0.336
Number of reflections	33449	2641
<I/σ(I)>	8.2
Completeness [%]	97.4
Redundancy	6.5
CC(1/2)		0.781

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	COUNTER-DIFFUSION		289.15	0.1 M HEPES/sodium hydroxide pH7.5, 20% polyethylene glycol 10000