3CSK

Structure of DPP III from Saccharomyces cerevisiae

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	CCD
Collection date	2007-06-23
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9537, 0.9779, 0.9787, 0.9180
Spacegroup name	P 1 21 1
Unit cell lengths	60.621, 110.121, 67.908
Unit cell angles	90.00, 113.45, 90.00

Refinement procedure

Resolution	30.000 - 1.950
R-factor	0.192
Rwork	0.192
R-free	0.22800
Structure solution method	MAD
RMSD bond length	0.015
RMSD bond angle	0.578
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHENIX
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.060
High resolution limit [Å]	1.950	1.950
Number of reflections	57149
<I/σ(I)>	11.5	2.5
Completeness [%]	95.5	99.5
Redundancy	2.9	2.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	20% w/v PEG 3350, 900mM MgCl2, 100mM TrisHCl, pH 7, VAPOR DIFFUSION, SITTING DROP, temperature 293K