8J7E

Crystal structure of BRIL in complex with 1b3 Fab

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-05-14
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9791
Spacegroup name	P 31 2 1
Unit cell lengths	116.319, 116.319, 212.326
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.010 - 2.800
R-factor	0.2022
Rwork	0.200
R-free	0.25050
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.812
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.010	2.900
High resolution limit [Å]	2.800	2.800
Rmerge		1.546
Rpim		0.352
Number of reflections	41670	4117
<I/σ(I)>	11.32
Completeness [%]	99.9
Redundancy	20
CC(1/2)	0.996	0.768

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIQUID DIFFUSION		295.15	0.1 M sodium acetate pH 5.0, 15% (w/v) PEG 6000