7BUI

Complex of reduced oxygenase and oxidized ferredoxin in carbazole 1,9a- dioxygenase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	90
Detector technology	CCD
Collection date	2009-11-30
Detector	RAYONIX MX225HE
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	97.290, 81.560, 116.130
Unit cell angles	90.00, 100.12, 90.00

Refinement procedure

Resolution	62.170 - 2.150
R-factor	0.1899
Rwork	0.187
R-free	0.23770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2de5
RMSD bond length	0.008
RMSD bond angle	1.585
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	150.000	2.190
High resolution limit [Å]	2.150	2.150
Rmerge	0.082
Number of reflections	97397	4789
<I/σ(I)>	12.7
Completeness [%]	99.9
Redundancy	7.5
CC(1/2)		0.680

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	Buffer: 50 mM Tris pH 7.5, 10% v/v glycerol, Reservior: 0.1 M sodium cacodylate pH 5.7, 14% w/v PEG 3350