5JW6

Cystal structure of aspartate semialdehyde dehydrogenase from Aspergillus fumigatus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-BM
Synchrotron site	APS
Beamline	19-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2016-03-26
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.97927
Spacegroup name	P 31 2 1
Unit cell lengths	94.500, 94.500, 202.140
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	81.840 - 2.390
R-factor	0.2034
Rwork	0.201
R-free	0.25020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3hsk
RMSD bond length	0.017
RMSD bond angle	1.924
Data reduction software	iMOSFLM
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	81.840	2.480
High resolution limit [Å]	2.390	2.390
Rmerge	0.058	0.224
Number of reflections	42496
<I/σ(I)>	9.2	3.2
Completeness [%]	100.0	100
Redundancy	6.2	5
CC(1/2)	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	2M ammonium sulphate 100 mM Bis-tris pH 6.5