9DDS

Crystal structure of human AAGAB G domain with E144K mutation

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-10
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.992280
Spacegroup name	P 21 21 21
Unit cell lengths	39.268, 94.349, 102.796
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.140 - 1.780
R-factor	0.189
Rwork	0.188
R-free	0.21270
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.124
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.140	1.844
High resolution limit [Å]	1.780	1.780
Rmerge	0.119	0.841
Rmeas	0.125	0.985
Number of reflections	34572	2096
<I/σ(I)>	14.4
Completeness [%]	93.0
Redundancy	9.6
CC(1/2)	1.000	0.508

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289.15	0.1M Bis-Tris pH5.5, 29% PEG3350