8IK2

RhlA exhibits dual thioesterase and acyltransferase activities during rhamnolipid biosynthesis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NFPSS BEAMLINE BL19U1
Synchrotron site	NFPSS
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-06
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97853
Spacegroup name	P 21 21 21
Unit cell lengths	47.629, 63.890, 85.004
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.757 - 2.151
R-factor	0.164
Rwork	0.160
R-free	0.19970
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	0.867
Data reduction software	HKL-3000
Data scaling software	Aimless
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.760	2.230
High resolution limit [Å]	2.150	2.150
Rmerge	0.099	0.099
Number of reflections	27004	27004
<I/σ(I)>	20.3
Completeness [%]	99.4	99.43
Redundancy	12.4	12.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277.15	sodium/potassium phosphate