5YCL

Crystal structure of HigBA complex from Shigella flexneri

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2015-12-13
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97960
Spacegroup name	P 31 2 1
Unit cell lengths	78.209, 78.209, 183.824
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	38.250 - 3.101
R-factor	0.2715
Rwork	0.268
R-free	0.30290
RMSD bond length	0.002
RMSD bond angle	0.632
Data scaling software	HKL-2000
Phasing software	PHENIX (1.10.1_2155)
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall
Low resolution limit [Å]	38.250
High resolution limit [Å]	3.101
Number of reflections	12386
<I/σ(I)>	29.19
Completeness [%]	100.0
Redundancy	34.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	25 % PEG 3350, 0.1 M HEPES pH 7.5, and 0.2 M lithium sulfate monohydrate