8CHX

Structure and function of LolA from Vibrio cholerae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-11-14
Detector	DECTRIS PILATUS3 X 2M
Wavelength(s)	0.8731
Spacegroup name	P 1 21 1
Unit cell lengths	46.485, 91.394, 48.459
Unit cell angles	90.00, 90.04, 90.00

Refinement procedure

Resolution	42.800 - 1.800
Rwork	0.210
R-free	0.25490
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.856
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX (1.17)
Refinement software	PHENIX (1.17)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.830	1.840
High resolution limit [Å]	1.800	1.800
Rmerge	0.102	0.711
Rmeas	0.108	0.749
Rpim	0.034	0.234
Total number of observations	375785
Number of reflections	37905	2234
<I/σ(I)>	15.3
Completeness [%]	99.9	100
Redundancy	9.9	10.2
CC(1/2)	0.998	0.871

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	291	0.1 M MES pH 5.0, 20 mM Zinc-acetate, 20% PEG4000