8YSJ

Crystal structure of the Deinococcus wulumuqiensis CD-NTase DwCdnB in complex with UMPNPP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-10-27
Detector	DECTRIS EIGER2 X 9M
Wavelength(s)	0.99984
Spacegroup name	P 1
Unit cell lengths	35.346, 46.244, 61.058
Unit cell angles	74.40, 73.13, 84.27

Refinement procedure

Resolution	28.287 - 1.903
Rwork	0.171
R-free	0.20740
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.431
Data scaling software	HKL-2000
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.970
High resolution limit [Å]	1.900	1.900
Rmerge	0.024
Number of reflections	26385	2673
<I/σ(I)>	32.553
Completeness [%]	95.0
Redundancy	2.1
CC(1/2)		0.972

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.1 M Bis-Tris pH6.5, 20 % w/v PEG 5000 MME.