7JH0

Crystallographic structure of glyceraldehyde-3-phosphate dehydrogenase from Schistosoma mansoni

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	2020-02-06
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.978
Spacegroup name	P 61
Unit cell lengths	80.123, 80.123, 417.015
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	57.760 - 2.510
R-factor	0.2158
Rwork	0.213
R-free	0.27260
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4k9d
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	57.760	2.570
High resolution limit [Å]	2.510	2.510
Rmeas	0.172	2.654
Number of reflections	51375	3515
<I/σ(I)>	14.35	1.13
Completeness [%]	99.9	99.9
Redundancy	21.57
CC(1/2)	0.999	0.501

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291.15	0.12 M Ethylene glycols (0.3 M diethyleneglycol, 0.3 M triethyleneglycol, 0.3 M tetraethyleneglycol, 0.3 M pentaethyleneglycol) , 0.1 M Buffer system 1 pH 6.5 (0,1 M MES/Imidazole) and 30% Mix of precipitants (20% V/V Glicerol e 10% w/V PEG 40,000)