1FUE

FLAVODOXIN FROM HELICOBACTER PYLORI

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	OTHER
Temperature [K]	298
Detector technology	IMAGE PLATE
Collection date	1998-10-27
Detector	MARRESEARCH
Spacegroup name	P 1 21 1
Unit cell lengths	31.130, 47.220, 48.310
Unit cell angles	90.00, 97.14, 90.00

Refinement procedure

Resolution	18.760 - 2.400
R-factor	0.198
Rwork	0.198
R-free	0.26700 *
RMSD bond length	0.007
RMSD bond angle	1.100
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.490
High resolution limit [Å]	2.400	2.400
Rmerge	0.085	0.325
Total number of observations	13654 *
Number of reflections	5346
<I/σ(I)>	12.1
Completeness [%]	96.6	99.2
Redundancy	2.46	2.48

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	17 *	PEG 1500, pH 7, VAPOR DIFFUSION, SITTING DROP, temperature 290K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	5 (mg/ml)
2	1	reservoir	PEG1500	30 (%(w/w))