9H9S

Crystal structure of a lectin-like protein from Ustilago maydis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-08-20
Detector	DECTRIS EIGER2 X CdTe 16M
Wavelength(s)	0.976260
Spacegroup name	F 2 3
Unit cell lengths	159.950, 159.950, 159.950
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.230 - 2.010
R-factor	0.1898
Rwork	0.188
R-free	0.21630
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	0.737
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.230	2.082
High resolution limit [Å]	2.010	2.010
Rmerge	0.144	2.947
Rmeas	0.145	3.014
Rpim	0.023	0.623
Number of reflections	22626	2223
<I/σ(I)>	19.1	0.77
Completeness [%]	99.8	98.93
Redundancy	38.4	22.8
CC(1/2)	1.000	0.357

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	0.1 M HEPES pH 7.5 1.26 M Ammonium sulfate