2BGI

X-Ray Structure of the Ferredoxin-NADP(H) Reductase from Rhodobacter capsulatus complexed with three molecules of the detergent n-heptyl- beta-D-thioglucoside at 1.7 Angstroms

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-2
Synchrotron site	ESRF
Beamline	ID14-2
Temperature [K]	100
Detector technology	CCD
Collection date	2004-05-17
Detector	ADSC CCD
Spacegroup name	P 31 2 1
Unit cell lengths	120.848, 120.848, 50.709
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.640 - 1.680
R-factor	0.221
Rwork	0.221
R-free	0.22500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1a8p
RMSD bond length	0.007
RMSD bond angle	1.600
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	AMoRE
Refinement software	CNS (1.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.600	1.800
High resolution limit [Å]	1.700	1.700
Rmerge	0.120	0.650
Number of reflections	61984
<I/σ(I)>	11.2	2.6
Completeness [%]	97.2	90
Redundancy	7.3	7.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.5		pH 6.50