6Y0D

Crystal structure of Trypanosoma cruzi antigen TcSMP11.90

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-02-10
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.9795
Spacegroup name	C 1 2 1
Unit cell lengths	95.890, 33.192, 67.445
Unit cell angles	90.00, 108.06, 90.00

Refinement procedure

Resolution	44.180 - 1.620
R-factor	0.1941
Rwork	0.192
R-free	0.22930
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5klh
RMSD bond length	0.009
RMSD bond angle	0.953
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.120	1.710
High resolution limit [Å]	1.620	1.620
Number of reflections	26050	3749
<I/σ(I)>	13.9
Completeness [%]	99.9
Redundancy	6.2
CC(1/2)	0.999	0.694

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M SPG buffer pH 5, 20% w/v PEG1500