5CQD

Crystal Structure of the Cancer Genomic DNA Mutator APOBEC3B

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	CCD
Collection date	2014-06-21
Detector	ADSC QUANTUM 315
Wavelength(s)	0.979
Spacegroup name	P 1 21 1
Unit cell lengths	53.440, 50.840, 70.150
Unit cell angles	90.00, 100.83, 90.00

Refinement procedure

Resolution	46.140 - 2.080
R-factor	0.1897
Rwork	0.188
R-free	0.22680
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3v4k
RMSD bond length	0.005
RMSD bond angle	0.566
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((dev_2166: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.800	2.160
High resolution limit [Å]	2.080	2.080
Rmerge		0.446
Number of reflections	18464
<I/σ(I)>	12.4
Completeness [%]	86.0
Redundancy	2.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	PEG3350, MES-NaOH