8QLH

Crystal structure of the pneumococcal Substrate-binding protein AliC as a domain-swapped dimer

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	2019-07-13
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97
Spacegroup name	C 1 2 1
Unit cell lengths	186.215, 60.514, 63.697
Unit cell angles	90.00, 96.23, 90.00

Refinement procedure

Resolution	57.519 - 2.380
R-factor	0.1787
Rwork	0.176
R-free	0.22640
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	57.520	2.460
High resolution limit [Å]	2.380	2.380
Rmerge		0.657
Number of reflections	28215	2820
<I/σ(I)>	11.2
Completeness [%]	98.9
Redundancy	5.2
CC(1/2)	0.990	0.800

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.1 M Bis-Tris pH=6.5 and 25% PEG3350