5E3A

Structure of human DPP3 in complex with opioid peptide leu-enkephalin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-04-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.972390
Spacegroup name	C 1 2 1
Unit cell lengths	119.558, 105.757, 64.992
Unit cell angles	90.00, 93.43, 90.00

Refinement procedure

Resolution	39.576 - 2.050
R-factor	0.2113
Rwork	0.209
R-free	0.25990
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3t6b
RMSD bond length	0.002
RMSD bond angle	0.616
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHENIX (1.9_1692)
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.580	2.121
High resolution limit [Å]	2.050	2.050
Rmerge	0.089	0.620
Number of reflections	48267
<I/σ(I)>	10.73	1.85
Completeness [%]	95.1	95.45
Redundancy	3	3.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.2	293	0.056M SODIUM PHOSPHATE MONOBASIC MONOHYDRATE, 1.344M POTASSIUM PHOSPHATE DIBASIC