5NCN

Crystal structure Dbf2(NTR)-Mob1 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-G
Synchrotron site	APS
Beamline	21-ID-G
Temperature [K]	100
Detector technology	CCD
Collection date	2016-04-18
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1
Spacegroup name	P 61 2 2
Unit cell lengths	108.620, 108.620, 135.210
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	44.423 - 3.501
R-factor	0.2199
Rwork	0.218
R-free	0.25730
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5brk
RMSD bond length	0.010
RMSD bond angle	0.756
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((dev_2420: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.423	3.590
High resolution limit [Å]	3.500	3.500
Rmeas	0.750	3.690
Number of reflections	6385
<I/σ(I)>	9.34	1.49
Completeness [%]	99.9	100
Redundancy	24.6	25.8
CC(1/2)	0.990	0.791

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	8.5	295	100mM Bicine/Tris, 30mM LiCl, 30mM NaCl, 30mM KCl, 30mM RbCl, 12.5% (w/v) PEG1000, 12.5% (w/v) PEG3350, 12.5% (v/v) MPD.