6QZW

DPP8 bound to a dipeptide (MP) from the N-terminus of BRCA2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-09-12
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	1.00000
Spacegroup name	C 2 2 21
Unit cell lengths	162.730, 246.074, 261.812
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.580 - 3.200
R-factor	0.18599
Rwork	0.184
R-free	0.22478
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6eoo
RMSD bond length	0.003
RMSD bond angle	0.984
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.8.0232)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.580	3.280
High resolution limit [Å]	3.200	3.200
Rmerge	0.134	1.310
Number of reflections	86559	6331
<I/σ(I)>	17.2	1.8
Completeness [%]	99.9
Redundancy	8.37
CC(1/2)	0.990	0.730

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.75	277	10 mg/ml of protein, 0.46 M Na citrate. Drops are set in a 1:1 ratio