3G0Z

Structure of S. pombe Pop2p - Zn2+ and Mn2+ bound form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX II BEAMLINE I911-3
Synchrotron site	MAX II
Beamline	I911-3
Temperature [K]	100
Detector technology	CCD
Collection date	2007-11-20
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	1.271
Spacegroup name	P 21 21 21
Unit cell lengths	52.733, 53.814, 94.332
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.166 - 2.004
R-factor	0.207
Rwork	0.206
R-free	0.24700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2p51
RMSD bond length	0.007
RMSD bond angle	0.987
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.200	2.070
High resolution limit [Å]	2.000	2.000
Rmerge	0.065	0.388
Total number of observations	259583
Number of reflections	17779
<I/σ(I)>	22.468	3
Completeness [%]	95.3	76.7
Redundancy	6.6	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8	277	18% PEG 3350, 200mM sodium formate, 5mM beta-mercaptoethanol, 7.1mM MgCl2, 0.075mM MnCl2, 0.22mM ZnCl2, pH 8.0, VAPOR DIFFUSION, temperature 277K