6D0U

Crystal structure of C05 V110P/A117E mutant bound to H3 influenza hemagglutinin, HA1 subunit

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-14
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0332
Spacegroup name	P 1 21 1
Unit cell lengths	91.605, 258.422, 91.876
Unit cell angles	90.00, 90.54, 90.00

Refinement procedure

Resolution	50.000 - 3.250
R-factor	0.25437
Rwork	0.254
R-free	0.26824
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB 4FP8
RMSD bond length	0.012
RMSD bond angle	1.392
Data scaling software	HKL-2000 (712)
Phasing software	PHASER (2.5.6)
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.350
High resolution limit [Å]	3.250	3.250
Rpim	0.090	0.430
Number of reflections	64646	5630
<I/σ(I)>	8.9	1.1
Completeness [%]	96.0	93
Redundancy	4.3	3.9
CC(1/2)	0.990	0.500

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	293	0.1 M sodium citrate pH 5.5 and 20% PEG 3000