6JHA

Crystal structure of NADPH bound AerF from Microcystis aeruginosa

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-04-27
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97923
Spacegroup name	P 43 2 2
Unit cell lengths	101.625, 101.625, 115.650
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 - 1.780
R-factor	0.19118
Rwork	0.189
R-free	0.23094
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6jh7
RMSD bond length	0.014
RMSD bond angle	1.685
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.810
High resolution limit [Å]	1.780	1.780
Rmerge	0.074	0.970
Number of reflections	57850	2872
<I/σ(I)>	35.451	3.165
Completeness [%]	98.8	99.7
Redundancy	10.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		285	0.1 M Na HEPES pH7.5, 25 % (w/v) PEG2000 MME