6N48

Structure of beta2 adrenergic receptor bound to BI167107, Nanobody 6B9, and a positive allosteric modulator

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	80
Detector technology	PIXEL
Collection date	2018-07-15
Detector	DECTRIS EIGER X 9M
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	49.150, 66.060, 303.510
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.921 - 3.200
R-factor	0.2529
Rwork	0.251
R-free	0.27390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4lde
RMSD bond length	0.004
RMSD bond angle	0.619
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.000	3.300
High resolution limit [Å]	3.200	3.200
Number of reflections	16912	1380
<I/σ(I)>	8.95	1.04
Completeness [%]	98.4	91.3
Redundancy	31.35	11.1
CC(1/2)	0.986	0.584

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIPIDIC CUBIC PHASE	8	293	100 mM Tris-HCl, pH 8.0, 150-200 mM lithium acetate, 43-45% PEG400