8II9

crystal structure of Hyp mutant from Hypoxylon sp. E7406B

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-09-01
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.0
Spacegroup name	P 1
Unit cell lengths	45.848, 86.155, 102.173
Unit cell angles	77.49, 85.95, 87.72

Refinement procedure

Resolution	34.790 - 2.170
R-factor	0.2257
Rwork	0.224
R-free	0.26310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	AlphaFold
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	72.310	2.230
High resolution limit [Å]	2.170	2.170
Number of reflections	78953	5754
<I/σ(I)>	7.3
Completeness [%]	98.1
Redundancy	3.8
CC(1/2)	0.780	0.610

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	13% PEG4000, 0.1 M Na3Cit, pH5.6, 0.15 M NaCl, 0.01 M MgCl2