8RPB

Structure of S79 Fab in complex with IgV domain of human PD-L1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX IV BEAMLINE BioMAX
Synchrotron site	MAX IV
Beamline	BioMAX
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-07-06
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9763
Spacegroup name	P 62 2 2
Unit cell lengths	185.852, 185.852, 110.237
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	48.240 - 2.794
R-factor	0.23
Rwork	0.229
R-free	0.25080
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.960
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	BUSTER (2.11.8 (8-JUN-2022))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.240	2.940
High resolution limit [Å]	2.790	2.790
Rmerge	0.205	3.089
Rpim	0.043	0.637
Number of reflections	28276	3987
<I/σ(I)>	11.8	1.3
Completeness [%]	99.7	98.1
Redundancy	24	23.9
CC(1/2)	0.995	0.622

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293.15	0.1M Tris pH 8.0, 1.6M Li2SO4