6P5R

Structure of T. brucei MERS1-GDP complex

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.3.1
Synchrotron site	ALS
Beamline	8.3.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-12-02
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.979
Spacegroup name	C 2 2 21
Unit cell lengths	90.815, 114.453, 77.964
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.173 - 2.450
R-factor	0.2298
Rwork	0.227
R-free	0.25620
Structure solution method	MAD
RMSD bond length	0.003
RMSD bond angle	0.666
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	AutoSol
Refinement software	PHENIX (1.12_2829)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	77.900	2.529
High resolution limit [Å]	2.450	2.450
Rmerge	0.051	0.275
Rpim	0.031	0.217
Number of reflections	14927	1199
<I/σ(I)>	12	2.7
Completeness [%]	98.7	94
Redundancy	4	4
CC(1/2)	0.998	0.965

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	Peg 3350, Magnesium formate