8YDO

Crystal structure of dKeima570

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2017-12-29
Detector	ADSC QUANTUM 270
Wavelength(s)	0.975
Spacegroup name	P 31
Unit cell lengths	83.713, 83.713, 103.314
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	27.400 - 2.000
R-factor	0.1634
Rwork	0.162
R-free	0.20028
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.640
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.030
High resolution limit [Å]	2.000	2.000
Rmerge	0.088	0.375
Rmeas	0.101
Rpim	0.048
Number of reflections	54496	2742
<I/σ(I)>	25.79	3.76
Completeness [%]	99.5	99.3
Redundancy	4	3.7
CC(1/2)		0.934

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	Na-cacodylate, magnesium acetate, Polyethylene glycol 8000