6XAW

Crystal Structure Analysis of SIN3-UME6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-02-15
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9197
Spacegroup name	P 43 2 2
Unit cell lengths	56.770, 56.770, 63.900
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.990 - 1.840
R-factor	0.193
Rwork	0.192
R-free	0.21200
Structure solution method	SAD
Data reduction software	XDS
Data scaling software	xia2
Phasing software	SOLVE
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	33.990	34.000	1.870
High resolution limit [Å]	1.840	4.990	1.840
Rmeas	0.174	0.054	2.656
Rpim	0.049	0.016	0.739
Total number of observations		6172	5739
Number of reflections	17236	562	449
<I/σ(I)>	16.4	46.5	1
Completeness [%]	99.8	100	98.9
Redundancy	12.3	11	12.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.8	293	100mM Tris, pH 8.8, 1.36M sodium citrate