4YBA

The structure of the C.Kpn2I controller protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	120
Detector technology	PIXEL
Collection date	2014-01-31
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97949
Spacegroup name	P 21 21 21
Unit cell lengths	36.890, 44.730, 109.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	22.370 - 1.700
R-factor	0.19209
Rwork	0.190
R-free	0.22604
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ir6
RMSD bond length	0.013
RMSD bond angle	1.562
Data reduction software	MOSFLM (7.0.9)
Data scaling software	SCALA (3.3.21)
Phasing software	PHASER (2.5.1)
Refinement software	REFMAC (5.8.0103)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.460	1.730
High resolution limit [Å]	1.700	1.700
Rmerge	0.078	0.611
Number of reflections	17568
<I/σ(I)>	7.8	2.3
Completeness [%]	86.7	89
Redundancy	3.4	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	289	0.2 LiSO4, 0.1 M Bis Tris methane pH5.5, 25% PEG3350; cryoprotection: 30% PEG3350, 10% glycerol