4YP9

Crystal Structure of LuxP In Complex With a Formose Derived AI-2 Analogue

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM14
Synchrotron site	ESRF
Beamline	BM14
Temperature [K]	100
Detector technology	CCD
Collection date	2009-04-09
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.97618
Spacegroup name	P 43
Unit cell lengths	104.732, 104.732, 69.532
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.800 - 2.700
R-factor	0.1694
Rwork	0.167
R-free	0.21850
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1jx6
RMSD bond length	0.011
RMSD bond angle	1.062
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.2_1309))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.800	2.800
High resolution limit [Å]	2.700	2.700
Rmerge	0.172	0.532
Number of reflections	20731
<I/σ(I)>	7.26	2.1
Completeness [%]	99.2	96.5
Redundancy	3.7	3.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	MgAc, PEG 8000, sodium cacodylate