2W6B

Crystal Structure of the Trimeric beta-PIX Coiled-Coil Domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	P 63
Unit cell lengths	43.120, 43.120, 79.430
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	39.720 - 2.800
R-factor	0.279
Rwork	0.278
R-free	0.30500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ba2
RMSD bond length	0.014
RMSD bond angle	1.563
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.900
High resolution limit [Å]	2.800	2.800
Rmerge	0.080	0.240
Number of reflections	2079
<I/σ(I)>	25.7	14.5
Completeness [%]	99.5	100
Redundancy	21	22

Crystallization Conditions

crystal ID	method	pH	temperature	details
1				35% MPD, 0.24 M NON-DETERGENT SULPHOBETAINE 195 (NDSB-195)