3CCX

ALTERING SUBSTRATE SPECIFICITY AT THE HEME EDGE OF CYTOCHROME C PEROXIDASE

Experimental procedure

Spacegroup name	P 21 21 21
Unit cell lengths	105.200, 74.300, 45.400
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	5.000 - 2.300
R-factor	0.174 *
Rwork	0.170
RMSD bond length	0.015
RMSD bond angle	2.800
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall
High resolution limit [Å]	2.200 *
Rmerge	0.067 *
Total number of observations	17059 *
Completeness [%]	97.0 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	enzyme	0.17 (mM)
2	1	drop	potassium phosphate	17-64 (mM)
3	1	drop	MPD	10 (%)
4	1	reservoir	MPD	25 (%)