6C85

Crystal structure of aspartate semialdehyde dehydrogenase from Blastomyces dermatitidis with p-benzoquinone

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-24
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0332
Spacegroup name	P 32 2 1
Unit cell lengths	107.351, 107.351, 223.096
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	71.417 - 2.400
R-factor	0.2019
Rwork	0.200
R-free	0.24130
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3hsk
Data reduction software	XDS
Data scaling software	Aimless (0.5.31)
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	85.800	2.470
High resolution limit [Å]	2.400	2.400
Rmerge	0.049
Number of reflections	59089	4511
<I/σ(I)>	15.7	2.96
Completeness [%]	100.0	100
Redundancy	9.7	9.7
CC(1/2)	0.999	0.953

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	293	0.2M Ammonium Citrate Tribasic pH 7.0, 18 % w/v PEG 3350