2QB1

2TEL crystallization module

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Detector technology	CCD
Detector	ADSC QUANTUM 210
Wavelength(s)	0.97
Spacegroup name	P 31
Unit cell lengths	65.686, 65.686, 36.144
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	56.890 - 2.610
R-factor	0.212
Rwork	0.211
R-free	0.24100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ji7
RMSD bond length	0.009
RMSD bond angle	1.310
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC (refmac_5.2.0019)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	90.000	90.000	2.690
High resolution limit [Å]	2.600	5.600	2.600
Rmerge	0.092	0.066	0.471
Number of reflections	5306
<I/σ(I)>	14.2
Completeness [%]	99.0	97.1	98.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5		0.3M MnCl2, 0.1M sodium acetate , pH 5, VAPOR DIFFUSION, HANGING DROP