2FF1

Crystal structure of Trypanosoma vivax nucleoside hydrolase soaked with ImmucillinH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE BW7A
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	BW7A
Temperature [K]	100
Detector technology	CCD
Collection date	2004-11-25
Detector	MAR CCD 165 mm
Wavelength(s)	0.9322
Spacegroup name	P 1 21 1
Unit cell lengths	51.500, 73.110, 82.350
Unit cell angles	90.00, 104.10, 90.00

Refinement procedure

Resolution	25.000 - 2.070
R-factor	0.178
Rwork	0.178
R-free	0.22500
Structure solution method	Isomorphous to PDB entry 1HOZ
RMSD bond length	0.010
RMSD bond angle	1.554
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	2.070
High resolution limit [Å]	2.000	2.000
Rmerge	0.059	0.341
Number of reflections	39979
<I/σ(I)>	13.27	3.85
Completeness [%]	99.9	99.9
Redundancy	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	1.6 M ammonium sulphate, 100 mM Tris , pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K