5FSZ

Crystal structure of Trypanosoma cruzi macrodomain

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	2015-10-01
Detector	DECTRIS PILATUS 6M-F
Spacegroup name	P 42 21 2
Unit cell lengths	74.820, 74.820, 75.440
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	18.860 - 2.000
R-factor	0.19155
Rwork	0.188
R-free	0.25796
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5fsu
RMSD bond length	0.010
RMSD bond angle	1.393
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0131)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.050
High resolution limit [Å]	2.000	2.000
Rmerge	0.130
Number of reflections	15003
<I/σ(I)>	10.7	1.5
Completeness [%]	99.8	100
Redundancy	10.4	11.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		8		0.1 M BIS-TRIS PROPANE PH 8.0, 0.96 M TRISODIUM CITRATE