7XL0

Crystal structure of Vobarilizumab at 1.70 Angstrom

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-03-16
Detector	DECTRIS EIGER R 4M
Wavelength(s)	1.000
Spacegroup name	C 1 2 1
Unit cell lengths	124.591, 56.420, 42.240
Unit cell angles	90.00, 101.92, 90.00

Refinement procedure

Resolution	51.250 - 1.700
R-factor	0.1539
Rwork	0.152
R-free	0.19630
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5hvg
RMSD bond length	0.006
RMSD bond angle	1.353
Data reduction software	MOSFLM (7.2.2)
Data scaling software	SCALA (3.3.22)
Phasing software	PHASER (2.8.2)
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.000	1.790
High resolution limit [Å]	1.700	1.700
Rmerge	0.092	0.336
Rpim	0.040	0.160
Number of reflections	31315	4232
<I/σ(I)>	11.5	4.4
Completeness [%]	98.9
Redundancy	6
CC(1/2)	0.995	0.890

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.2 M lithium sulfate 20% PEG 3,350