6VL8

Anti-PEG antibody 6-3 Fab fragment in complex with PEG

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	93
Detector technology	PIXEL
Collection date	2019-06-06
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	112.108, 87.791, 116.074
Unit cell angles	90.00, 113.66, 90.00

Refinement procedure

Resolution	41.920 - 2.420
R-factor	0.1859
Rwork	0.184
R-free	0.24030
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3o2v
RMSD bond length	0.009
RMSD bond angle	0.942
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.18_3845)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.930	2.480
High resolution limit [Å]	2.420	2.420
Number of reflections	78203	3823
<I/σ(I)>	17.1	2.4
Completeness [%]	99.8
Redundancy	6.1
CC(1/2)	0.980	0.920

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	25% PEG 1500, 100 mM MMT buffer pH 6.5