5Z14

Crystal structure of human TLR8 in complex with CU-CPT9a

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	95
Detector technology	CCD
Collection date	2016-11-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0000
Spacegroup name	C 1 2 1
Unit cell lengths	143.510, 99.000, 139.490
Unit cell angles	90.00, 108.51, 90.00

Refinement procedure

Resolution	44.090 - 2.800
R-factor	0.20456
Rwork	0.201
R-free	0.27698
RMSD bond length	0.010
RMSD bond angle	1.567
Data reduction software	iMOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	132.270	2.950
High resolution limit [Å]	2.800	2.800
Number of reflections	43515
<I/σ(I)>	14.2
Completeness [%]	99.0
Redundancy	6.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG 4000, calcium chloride, Tris-HCl, ethylene glycol