3PRV

Nucleoside diphosphate kinase B from Trypanosoma cruzi

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	LNLS BEAMLINE W01B-MX2
Synchrotron site	LNLS
Beamline	W01B-MX2
Temperature [K]	100
Detector technology	CCD
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.4586
Spacegroup name	P 41 21 2
Unit cell lengths	115.438, 115.438, 148.515
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.400 - 2.690
R-factor	0.22795
Rwork	0.223
R-free	0.31769
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.578
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.5.0102)

Data quality characteristics

	Overall
Low resolution limit [Å]	29.400
High resolution limit [Å]	2.690
Number of reflections	28446

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	100 mM HEPES pH 7.5, 12% (w/v) PEG-3350, VAPOR DIFFUSION, SITTING DROP, temperature 291K