8BF0

Structure of a Fab portion from TKH2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97242
Spacegroup name	P 1 21 1
Unit cell lengths	55.259, 65.111, 56.713
Unit cell angles	90.00, 104.55, 90.00

Refinement procedure

Resolution	44.270 - 1.750
R-factor	0.1694
Rwork	0.168
R-free	0.20210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6xtg
RMSD bond length	0.010
RMSD bond angle	0.881
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.270	1.813
High resolution limit [Å]	1.750	1.750
Rmerge	0.084	1.115
Number of reflections	39241	3924
<I/σ(I)>	10.5	1.6
Completeness [%]	99.6	99.85
Redundancy	5.5	5.6
CC(1/2)	0.997	0.700

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	25% PEG 3350, 0.1M Citric Acid pH 3.5