5JW3

Structure of MEDI8852 Fab Fragment in Complex with H7 HA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I02
Synchrotron site	Diamond
Beamline	I02
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-01-29
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97949
Spacegroup name	P 3 2 1
Unit cell lengths	143.990, 143.990, 130.920
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	48.433 - 3.750
R-factor	0.2269
Rwork	0.224
R-free	0.26310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4BSG (chains A+B) and 5JW5 (chains H+L)
RMSD bond length	0.007
RMSD bond angle	1.231
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.433		3.850
High resolution limit [Å]	3.750	16.770	3.750
Rmerge	0.122	0.018	1.271
Number of reflections	15424
<I/σ(I)>	9.89	52.09	1.1
Completeness [%]	93.5	82.5	95.3
Redundancy	3.56
CC(1/2)	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	45% PEP 15/4, 0.1 M Tris pH 8.5