8D3Z

Crystal structure of GalS1 in complex with Manganese from Populus trichocarpas

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2020-07-24
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0000
Spacegroup name	P 31 2 1
Unit cell lengths	169.982, 169.982, 73.960
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.070 - 2.560
R-factor	0.2314
Rwork	0.230
R-free	0.26390
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8d3t
RMSD bond length	0.007
RMSD bond angle	1.013
Data reduction software	DIALS
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.070	2.650
High resolution limit [Å]	2.560	2.560
Rmerge	0.018	0.350
Number of reflections	79592	7908
<I/σ(I)>	20.3
Completeness [%]	99.9
Redundancy	2
CC(1/2)	1.000	0.755

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M sodium citrate tribasic dihydrate pH 5.0 10 % PEG 6,000