6MKZ

Crystal structure of murine 4-1BB/4-1BBL complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-05-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97
Spacegroup name	P 21 21 21
Unit cell lengths	61.499, 88.478, 155.158
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.760 - 2.650
R-factor	0.206
Rwork	0.204
R-free	0.23800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5wi8 6mkb
RMSD bond length	0.010
RMSD bond angle	1.240
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	76.859	76.859	2.688
High resolution limit [Å]	2.624	7.354	2.624
Total number of observations	349768	15728	9414
Number of reflections	25447	1306	1263
<I/σ(I)>	5.6	7.8	1.7
Completeness [%]	97.6	99.8	71
Redundancy	13.7	12	7.5
CC(1/2)	0.960	0.949	0.755

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	20% PEG 4000, 0.2M ammonium chloride