1EWA

Dehaloperoxidase and 4-iodophenol

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	298
Detector technology	IMAGE PLATE
Collection date	1995-10-15
Detector	RIGAKU RAXIS II
Spacegroup name	P 21 21 21
Unit cell lengths	68.500, 68.400, 61.000
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.500
R-factor	0.201 *
Rwork	0.201
R-free	0.21900
RMSD bond length	0.011 *
RMSD bond angle	1.900 *
Data reduction software	DENZO
Data scaling software	SCALA
Phasing software	MLPHARE
Refinement software	CNS

Data quality characteristics

	Overall
Low resolution limit [Å]	10.000
High resolution limit [Å]	2.500
Rmerge	0.068
Total number of observations	20811 *
Number of reflections	8709
Redundancy	2.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5 *	277 *	Zhang, E., (1996) Acta Crystallogr., D52, 1191. *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	5-10 (mg/ml)
2	1	reservoir	ammonium sulfate	200 (mM)
3	1	reservoir	PEG8000	30 (%)