5UCG

Structure of the PP2C Phosphatase Domain and a Fragment of the Regulatory Domain of the Cell Fate Determinant SpoIIE from Bacillus Subtilis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-02-18
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9792
Spacegroup name	P 43 21 2
Unit cell lengths	125.622, 125.622, 330.696
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.054 - 3.906
R-factor	0.2786
Rwork	0.276
R-free	0.32250
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3t91
RMSD bond length	0.002
RMSD bond angle	0.525
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	60.000	60.000	3.970
High resolution limit [Å]	3.900	10.570	3.900
Rmerge	0.102	0.031	1.448
Rmeas	0.107	0.033	1.563
Rpim	0.031	0.009	0.563
Total number of observations	284918
Number of reflections	24917
<I/σ(I)>	4.3
Completeness [%]	99.7	99.4	97.4
Redundancy	11.4	11.2	6.8
CC(1/2)		0.999	0.847

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	0.5 mM LiSO4, 8% PEG8000, 0.05 mM NaF, 6% glycerol