6Z63

FtsE structure from Streptococus pneumoniae in complex with ADP at 1.57 A resolution (spacegroup P 21)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-17
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.96862
Spacegroup name	P 1 21 1
Unit cell lengths	33.047, 118.541, 82.372
Unit cell angles	90.00, 97.55, 90.00

Refinement procedure

Resolution	47.967 - 1.570
R-factor	0.1844
Rwork	0.183
R-free	0.21520
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ouk
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	BALBES
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.970	1.600
High resolution limit [Å]	1.570	1.570
Rmerge	0.081	0.817
Number of reflections	86937	4252
<I/σ(I)>	11.7
Completeness [%]	99.5
Redundancy	5
CC(1/2)	0.990	0.560

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.15 M NaF and 16% (w/v) PEG3350