6TAB

Bd0314 DslA wild-type form 2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-02-12
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.92819
Spacegroup name	P 21 21 21
Unit cell lengths	48.858, 64.670, 82.692
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.940 - 1.260
R-factor	0.1518
Rwork	0.150
R-free	0.17670
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	EtoQ_mutant
Data reduction software	XDS
Data scaling software	Aimless (0.5.31)
Phasing software	PHASER
Refinement software	PHENIX (1)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	64.650	10.000	1.290
High resolution limit [Å]	1.260	5.630	1.260
Rmerge	0.068	0.038	1.800
Rmeas	0.071	0.039	1.000
Rpim	0.020	0.011	0.696
Total number of observations	812815
Number of reflections	71428	934	5214
<I/σ(I)>	13.2
Completeness [%]	99.8	100	99.7
Redundancy	11.4	11.5	7.6
CC(1/2)	0.999	0.999	0.509

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.5	289	0.2M Lithium Sulphate 0.1M Acetate pH 4.5 30% PEG 8000