1B13

CLOSTRIDIUM PASTEURIANUM RUBREDOXIN G10A MUTANT

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	1996-07-01
Detector	RIGAKU RU200
Spacegroup name	H 3
Unit cell lengths	64.270, 64.270, 32.920
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 - 1.500
R-factor	0.171 *
Rwork	0.171
R-free	0.19100
Structure solution method	OTHER
Starting model (for MR)	5rxn
RMSD bond length	0.015
RMSD bond angle	0.018
Data reduction software	DENZO
Data scaling software	SCALEPACK
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.550
High resolution limit [Å]	1.500	1.500
Rmerge	0.080	0.245
Total number of observations	29561 *
Number of reflections	7662 *
<I/σ(I)>	12.5	2.2
Completeness [%]	94.5	59 *
Redundancy	3.3	1.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	4.6	277 *	PROTEIN WAS CRYSTALLISED FROM 50-60% SATURATED AMMONIUM SULFATE IN SODIUM ACETATE BUFFER (50 MM) AT PH 4.6.

Crystallization Reagents

ID	crystal ID	solution ID	reagent name	concentration	details
1	1	2	50-60% SATURATED AMMONIUM SULFATE
2	1	2	SODIUM ACETATE BUFFER (50 MM) AT PH 4.6.

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	7-20 (mg/ml)
2	1	drop	ammonium sulfate	2-35 (%)
3	1	drop	sodium acetate	50 (mM)
4	1	reservoir	ammonium sulfate	50-70 (%)
5	1	reservoir	sodium acetate	50 (mM)