1JYB

Crystal structure of Rubrerythrin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SEALED TUBE
Source details	CONVENTIONAL Cu
Temperature [K]	298
Detector technology	IMAGE PLATE
Collection date	1999-03-01
Detector	MARRESEARCH
Wavelength(s)	1.5418
Spacegroup name	I 2 2 2
Unit cell lengths	49.670, 81.552, 99.754
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.200
Rwork	0.182
R-free	0.23100
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.017
RMSD bond angle	2.800
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	15.000 *	2.390
High resolution limit [Å]	2.000	2.220
Rmerge	0.090	0.376
Number of reflections	10576 *
Completeness [%]	99.9 *	100
Redundancy	11.5 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7	298	PEG1500, Tris, pH 7.0, VAPOR DIFFUSION, temperature 298K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	10 (mg/ml)
2	1	drop	PEG1500	5 (%)
3	1	drop	Tris-Cl	50 (mM)	pH7.0
4	1	reservoir	PEG1500	10 (%)
5	1	reservoir	Tris-Cl	100 (mM)