5ZVV

Structure of SeMet-phAimR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-09-10
Detector	DECTRIS PILATUS3 R 1M
Wavelength(s)	0.97776
Spacegroup name	P 1 21 1
Unit cell lengths	61.469, 116.917, 68.244
Unit cell angles	90.00, 113.55, 90.00

Refinement procedure

Resolution	53.934 - 2.200
R-factor	0.2106
Rwork	0.208
R-free	0.25130
RMSD bond length	0.002
RMSD bond angle	0.456
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	53.934	2.279
High resolution limit [Å]	2.200	2.200
Number of reflections	44287
<I/σ(I)>	3.08
Completeness [%]	98.8
Redundancy	7.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	2% Tacsimate pH 6.0, 0.1 M Bis-Tris pH 6.5, 20% PEG 3350