8YSU

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

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 07A
Synchrotron site	NSRRC
Beamline	TPS 07A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-05-26
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.97624
Spacegroup name	P 1 21 1
Unit cell lengths	35.363, 111.506, 46.981
Unit cell angles	90.00, 100.42, 90.00

Refinement procedure

Resolution	23.881 - 1.944
Rwork	0.202
R-free	0.23890
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.444
Data scaling software	HKL-2000
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.010
High resolution limit [Å]	1.940	1.940
Number of reflections	25742	2511
<I/σ(I)>	15.424
Completeness [%]	98.2
Redundancy	6.5
CC(1/2)	0.995	0.705

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.1 M BIS-TRIS propane pH 9.0, 30% w/v Polyethylene glycol 6,000.