7XRE

Crystal structure of DgpA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	80
Detector technology	PIXEL
Collection date	2021-10-03
Detector	DECTRIS EIGER R 4M
Wavelength(s)	0.9875
Spacegroup name	P 21 21 21
Unit cell lengths	94.790, 130.760, 206.680
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	17.076 - 2.760
R-factor	0.2377
Rwork	0.235
R-free	0.29420
Structure solution method	SAD
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	AutoSol
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.700
High resolution limit [Å]	2.700	2.700
Rmerge	0.182
Number of reflections	65488	1013
<I/σ(I)>	10.6
Completeness [%]	98.2
Redundancy	11.5
CC(1/2)	0.750	0.800

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.2 M magnesium formate and 20% PEG 3350