7DPY

Structure of Brucella abortus PhiA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100.15
Detector technology	PIXEL
Collection date	2020-08-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97942
Spacegroup name	P 21 21 2
Unit cell lengths	66.155, 51.156, 62.303
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.360 - 1.800
R-factor	0.2009
Rwork	0.199
R-free	0.23090
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4mir
RMSD bond length	0.007
RMSD bond angle	0.951
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.830
High resolution limit [Å]	1.800	1.800
Rmerge	0.092	0.311
Rmeas	0.086	0.276
Rpim	0.025	0.097
Number of reflections	19949	964
<I/σ(I)>	23.7
Completeness [%]	99.0
Redundancy	9.7
CC(1/2)	1.000	0.953

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		287.15	0.1 M BIS-TRIS pH 6.0, 18% (w/v) PEG 10000