7YJW

Structure of Leptospira santarosai serovar shermani LRR protein LSS01692

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL15A1
Synchrotron site	NSRRC
Beamline	BL15A1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-06-27
Detector	RAYONIX MX300HE
Wavelength(s)	1.000
Spacegroup name	P 1 21 1
Unit cell lengths	65.713, 78.862, 66.578
Unit cell angles	90.00, 106.03, 90.00

Refinement procedure

Resolution	29.650 - 3.200
R-factor	0.2578
Rwork	0.253
R-free	0.30390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4u06
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	3.260
High resolution limit [Å]	3.200	8.620	3.200
Rmerge	0.080	0.014	0.619
Rmeas	0.094	0.016	0.738
Rpim	0.049	0.009	0.398
Total number of observations	39710
Number of reflections	10860	539	502
<I/σ(I)>	10.5
Completeness [%]	99.0	94.7	98.2
Redundancy	3.7	3.4	3.2
CC(1/2)		1.000	0.863

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	289	0.1 M Tris-HCl (pH=8.5), 2% Tasimate pH, and 16% PEG3350