5B3T

Crystal structure of apo-form biliverdin reductase from Synechocystis sp. PCC 6803

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	CCD
Collection date	2011-11-30
Detector	RAYONIX MX225HE
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	58.248, 88.497, 133.582
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.899 - 2.099
R-factor	0.2015
Rwork	0.200
R-free	0.23930
Structure solution method	SIRAS
RMSD bond length	0.002
RMSD bond angle	0.641
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.899	2.230
High resolution limit [Å]	2.099	2.100
Rmerge	0.097	0.429
Number of reflections	40823
<I/σ(I)>	18.2	4.02
Completeness [%]	99.0	95.1
Redundancy	6.93	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG4000, Tris-HCl (pH7.25), Sodium acetate, Cymal-2