3SWF

CNGA1 621-690 containing CLZ domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	77
Detector technology	CCD
Collection date	2010-10-21
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9791
Spacegroup name	P 21 21 21
Unit cell lengths	32.010, 76.710, 113.110
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	56.555 - 2.140
R-factor	0.2041
Rwork	0.203
R-free	0.23040
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3l36
RMSD bond length	0.007
RMSD bond angle	0.953
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.16)
Phasing software	PHASER
Refinement software	PHENIX (1.7_650)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	56.555	56.555	2.260
High resolution limit [Å]	2.140	6.770	2.140
Rmerge	0.149	0.074	0.775
Total number of observations		3843	10607
Number of reflections	16022
<I/σ(I)>	7.6	4.4	0.7
Completeness [%]	99.5	99.8	96.9
Redundancy	6.8	6.4	4.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	18.2% w/v PEG3350, 45 mM zinc acetate, 9 mM cobalt chloride, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K