7ES4

the crystral structure of DndH-C-domain

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	2020-02-14
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97916
Spacegroup name	P 65
Unit cell lengths	102.478, 102.478, 77.650
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 - 2.300
R-factor	0.1913
Rwork	0.189
R-free	0.23340
Structure solution method	SAD
RMSD bond length	0.009
RMSD bond angle	1.302
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	AutoSol
Refinement software	REFMAC (5.7.0032)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.340
High resolution limit [Å]	2.300	2.300
Number of reflections	20708	1029
<I/σ(I)>	42.1
Completeness [%]	100.0
Redundancy	20.4
CC(1/2)	0.972	0.977

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277.15	PEG 4000,magnesium chloride, HEPES