9NW5

3H4v31 anti-HLA-E-VL9 Fab

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	80
Detector technology	PIXEL
Collection date	2023-10-23
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.97741
Spacegroup name	P 21 21 21
Unit cell lengths	73.480, 82.811, 94.690
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	62.340 - 2.050
R-factor	0.2167
Rwork	0.215
R-free	0.24420
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.774
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (dev_3758)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	62.340	2.110
High resolution limit [Å]	2.050	2.050
Number of reflections	36913	2836
<I/σ(I)>	12.5	3.4
Completeness [%]	99.8
Redundancy	6.2
CC(1/2)	0.940	0.886

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	20.1% PEG 1500, 2.01% MPD, 0.2 M magnesium sulfate, 0.1 M sodium acetate pH 5.5