6PCZ

Crystal structure of the bacterial cellulose synthase subunit G (BcsG) catalytic domain from Escherichia coli, selenomethionine variant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-07
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97965
Spacegroup name	P 21 21 21
Unit cell lengths	78.710, 94.580, 105.190
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.970 - 1.440
R-factor	0.1969
Rwork	0.196
R-free	0.20830
Structure solution method	SAD
RMSD bond length	0.007
RMSD bond angle	0.879
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.970	1.491
High resolution limit [Å]	1.440	1.440
Rmerge	0.062	1.051
Rmeas	0.068	1.140
Rpim	0.026	0.440
Number of reflections	142124	14051
<I/σ(I)>	19.13	1.74
Completeness [%]	100.0	99.99
Redundancy	6.5	6.7
CC(1/2)	0.999	0.667

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	0.1 M HEPES:NaOH, 20% (w/v) PEG 4000, 10% (v/v) 2-propanol