8CGY

Trypanosoma brucei IMP dehydrogenase (ori) crystallized in High Five cells reveals native ligands ATP, GDP and phosphate. Diffraction data collection at 100 K in cellulo; XDS processing

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	2019-11-26
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.98
Spacegroup name	P 4 21 2
Unit cell lengths	207.100, 207.100, 92.500
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	92.620 - 3.000
R-factor	0.194
Rwork	0.192
R-free	0.23660
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.774
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	92.620	3.107
High resolution limit [Å]	3.000	3.000
Number of reflections	40798	9383
<I/σ(I)>	20.37
Completeness [%]	99.8
Redundancy	474
CC(1/2)	0.981	0.870

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	IN CELL		300	crystallized in Trichoplusia ni (High Five) cells infected with recombinant baculovirus encoding TbIMPDH ori in adhesion culture (MOI 1)