6Z9L

Enterococcal PrgA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-09-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.976247
Spacegroup name	P 43 2 2
Unit cell lengths	126.356, 126.356, 293.908
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.107 - 3.063
R-factor	0.2879
Rwork	0.286
R-free	0.31820
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6z9k
RMSD bond length	0.003
RMSD bond angle	0.576
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.10.1)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	49.107	49.107	3.250
High resolution limit [Å]	3.060	9.050	3.060
Rmerge	0.255	0.062	2.588
Rmeas	0.266	0.065	2.710
Total number of observations	577045
Number of reflections	45500	1964	7048
<I/σ(I)>	8.56	35.85	0.75
Completeness [%]	99.5	98.9	97.2
Redundancy	12.682	11.751	11.221
CC(1/2)	0.997	0.998	0.342

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	37.5% (v/v) PEG400, 0.1 M Tris/HCl (pH 8.5), 0.114 M LiSO4