6L8Q

Complex structure of bat CD26 and MERS-RBD

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	291
Detector technology	CCD
Collection date	2016-06-11
Detector	ADSC QUANTUM 315
Wavelength(s)	0.979
Spacegroup name	P 1 21 1
Unit cell lengths	114.657, 273.674, 115.234
Unit cell angles	90.00, 119.68, 90.00

Refinement procedure

Resolution	49.810 - 3.100
R-factor	0.202
Rwork	0.200
R-free	0.24060
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4kr0
RMSD bond length	0.004
RMSD bond angle	0.651
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.210
High resolution limit [Å]	3.097	3.100
Number of reflections	95308	11097
<I/σ(I)>	8.463
Completeness [%]	85.3
Redundancy	5.7
CC(1/2)	0.972	0.738

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2M imidazole malate, pH 8.5, 7.5% (w/v) PEG 10000