2EUN

Cytochrome c peroxidase (CCP) in complex with 2,4-diaminopyrimidine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2004-12-08
Detector	RIGAKU RAXIS IV
Spacegroup name	P 21 21 21
Unit cell lengths	43.850, 73.710, 105.220
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.000 - 1.700
R-factor	0.194
Rwork	0.193
R-free	0.22600
Structure solution method	MOLECULAR REPLACEMENT
Phasing software	AMoRE
Refinement software	REFMAC (5.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.850	1.540
High resolution limit [Å]	1.490	1.490
Rmerge	0.067
Number of reflections	38278
<I/σ(I)>	8.1
Completeness [%]	94.2	58
Redundancy	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	298	50 mM potassium phosphate 20% MPD, pH 6.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K