8K8H

Crystal structure of the CysR-CTLD3 fragment of human DEC205

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-01-29
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	141.582, 79.205, 89.542
Unit cell angles	90.00, 121.53, 90.00

Refinement procedure

Resolution	29.640 - 2.790
R-factor	0.1977
Rwork	0.191
R-free	0.26580
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6inn
RMSD bond length	0.009
RMSD bond angle	1.091
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.640	2.860
High resolution limit [Å]	2.790	2.790
Rpim	0.073	0.153
Number of reflections	21098	2214
<I/σ(I)>	13.3
Completeness [%]	99.4
Redundancy	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION		293	0.2 M Sodium Citrate, 20% PEG3350, final pH 6.5