9I40

Structure of anti-EV71 human monoclonal antibody 16-3-4D Fab

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-18
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9282
Spacegroup name	P 65 2 2
Unit cell lengths	121.415, 121.415, 361.684
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	90.900 - 2.780
R-factor	0.2425
Rwork	0.241
R-free	0.27690
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.570
Phasing software	MOLREP
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	90.900	2.850
High resolution limit [Å]	2.780	2.780
Number of reflections	40825	1957
<I/σ(I)>	15.5
Completeness [%]	100.0
Redundancy	18.9
CC(1/2)	1.000	0.500

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	2% (v/v) PEG 400, 2 M ammonium sulphate,0.1 M HEPES- Na, pH 7.5