1AKW

G61L OXIDIZED FLAVODOXIN MUTANT

Experimental procedure

Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE BW7B
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	BW7B
Temperature [K]	293
Detector technology	IMAGE PLATE
Collection date	1995-08
Detector	MARRESEARCH
Spacegroup name	P 21 21 2
Unit cell lengths	56.930, 88.610, 35.420
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	10.000 * - 1.750
R-factor	0.171 *
Rwork	0.179
R-free	0.19400
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	0.035
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	PROLSQ

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.750
High resolution limit [Å]	1.750	1.720
Rmerge	0.059 *	0.337 *
Total number of observations	110226 *
Number of reflections	18715
<I/σ(I)>	18	1.4
Completeness [%]	99.8	96.4 *
Redundancy		2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	7	18 *	60-70% AMMONIUM SULFATE, 100MM TRIS-HCL, pH 7.0

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	acetone	1-2 (%(v/v))
2	1	drop	Tris-HCl	10 (mM)
3	1	drop	EDTA	1 (mM)
4	1	drop	ammonium sulfate	60-70 (%)