6A3V

Complex structure of human 4-1BB and 4-1BBL

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	2017-02-04
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9789
Spacegroup name	P 1 21 1
Unit cell lengths	126.091, 137.195, 140.318
Unit cell angles	90.00, 111.80, 90.00

Refinement procedure

Resolution	44.666 - 3.391
R-factor	0.265
Rwork	0.264
R-free	0.29300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5l36
RMSD bond length	0.003
RMSD bond angle	0.691
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.666	3.520
High resolution limit [Å]	3.391	3.400
Rpim	0.121
Number of reflections	60878
<I/σ(I)>	10.7
Completeness [%]	98.8
Redundancy	3.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2M sodium iodide, 0.1M Bis Tris propane, pH 7.5, 20% w/v PEG 3350