9BYF

Fab 212-55 in complex with OspA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 19-ID
Synchrotron site	NSLS-II
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-03-12
Detector	DECTRIS EIGER2 S 9M
Wavelength(s)	0.979
Spacegroup name	C 2 2 2
Unit cell lengths	101.120, 162.416, 126.785
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.730 - 2.850
R-factor	0.2331
Rwork	0.230
R-free	0.28840
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.446
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.900
High resolution limit [Å]	2.850	7.730	2.850
Rmerge	0.353	0.083	1.911
Rmeas		0.088	2.015
Rpim		0.028	0.627
Number of reflections	24587	1321	1218
<I/σ(I)>	2.6
Completeness [%]	99.6	98.4	99.8
Redundancy	9.9	9.5	10.1
CC(1/2)		0.996	0.353

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	100 mM HEPES pH 7.5, 23% PEG 3350, and 200 mM NaCl