8JOR

Structure of an acyltransferase involved in mannosylerythritol lipid formation from Pseudozyma tsukubaensis in type A crystal

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-10-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9
Spacegroup name	P 21 21 21
Unit cell lengths	53.043, 83.073, 131.035
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.080 - 1.450
R-factor	0.172
Rwork	0.171
R-free	0.19430
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.897
Data reduction software	XDS (Jan 10, 2022)
Data scaling software	XDS (Jan 10, 2022)
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	44.730	44.730	1.530
High resolution limit [Å]	1.450	4.320	1.450
Rmerge	0.075	0.033	1.177
Rmeas	0.081	0.035	1.262
Rpim	0.030
Number of reflections	103745	4183	16481
<I/σ(I)>	15.68		2.29
Completeness [%]	99.8	99.6	99.2
Redundancy	7.4
CC(1/2)	0.999	0.999	0.729

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	21% PEG 3350, 300mM lithium chloride