7QP0

Crystal structure of metacaspase from candida glabrata with magnesium

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-07-03
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97857
Spacegroup name	C 1 2 1
Unit cell lengths	95.700, 83.600, 87.800
Unit cell angles	90.00, 106.60, 90.00

Refinement procedure

Resolution	38.380 - 1.600
R-factor	0.1767
Rwork	0.175
R-free	0.20230
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4f6o
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.380	1.800
High resolution limit [Å]	1.600	1.600
Rmeas	0.103	0.859
Number of reflections	87056	25834
<I/σ(I)>	8.44	1.84
Completeness [%]	99.6	99.7
Redundancy	3.5	3.4
CC(1/2)	0.997	0.760

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	7.6	292	0.2 M Mg Acetate, 20% (w/v) PEG 3350