5TU5

PagF prenyltransferase with Tyr-Tyr-Tyr and DMSPP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-G
Synchrotron site	APS
Beamline	21-ID-G
Temperature [K]	100
Detector technology	CCD
Collection date	2014-03-14
Detector	MARRESEARCH
Wavelength(s)	0.97856
Spacegroup name	P 65
Unit cell lengths	117.042, 117.042, 43.800
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	25.000 - 1.900
R-factor	0.20845
Rwork	0.207
R-free	0.23055
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.263
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	REFMAC (5.8.0151)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.930
High resolution limit [Å]	1.900	1.900
Number of reflections	27191
<I/σ(I)>	15.6
Completeness [%]	99.7
Redundancy	5.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		280	20-25% PEG 3350 20 mM Tris-HCl pH=7.5 200 mM NaCl