7RGN

Crystal structure of putative fructose-1,6-bisphosphate aldolase from Candida auris

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-04-21
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97918
Spacegroup name	P 65 2 2
Unit cell lengths	64.477, 64.477, 320.770
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.910 - 2.200
R-factor	0.1983
Rwork	0.194
R-free	0.23830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6lnk
RMSD bond length	0.003
RMSD bond angle	0.576
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.400
High resolution limit [Å]	2.200	2.200
Rmerge	0.098	1.440
Rpim	0.033	0.493
Number of reflections	21289	1032
<I/σ(I)>	21.72
Completeness [%]	99.7	99.8
Redundancy	9.3
CC(1/2)	0.998	0.563

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	298	10% isopropanol, 0.1 M bicine, pH 8.5, 30% w/v PEG1500, 1 mM zinc chloride