6JZU

The crystal structure of acyl-acyl carrier protein (acyl-ACP) reductase (AAR) in complex with aldehyde deformylating oxygenase (ADO)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-04-29
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	66.377, 71.313, 137.137
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.427 - 2.181
R-factor	0.2064
Rwork	0.203
R-free	0.25420
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4rc8
RMSD bond length	0.008
RMSD bond angle	0.857
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.430	2.260
High resolution limit [Å]	2.180	2.180
Rmerge	0.086	1.090
Rpim	0.025	0.310
Number of reflections	34553	1708
<I/σ(I)>	30
Completeness [%]	99.6
Redundancy	13.1
CC(1/2)		0.760

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION		298	0.1M HEPES, pH 7.5, 20% PEG 8000