6WJ1

Crystal structure of Fab 54-4H03 bound to H1 influenza hemagglutinin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-10-10
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0332
Spacegroup name	C 2 2 21
Unit cell lengths	231.538, 259.211, 165.113
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.217 - 3.503
R-factor	0.1817
Rwork	0.179
R-free	0.23170
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4m4y
Data reduction software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.610
High resolution limit [Å]	3.500	7.780	3.500
Rmerge	0.191	0.059	1.143
Rmeas	0.210	0.065	1.245
Rpim	0.084	0.026	0.484
Total number of observations	374579
Number of reflections	62420	5916	5623
<I/σ(I)>	4.4
Completeness [%]	99.8	99.7	99.8
Redundancy	6	5.9	6.3
CC(1/2)		0.997	0.678

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	11% PEG 6000 and 0.1 M MES pH 5.6