4L9O

Crystal Structure of the Sec13-Sec16 blade-inserted complex from Pichia pastoris

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X25
Synchrotron site	NSLS
Beamline	X25
Temperature [K]	100
Detector technology	CCD
Collection date	2010-06-05
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.10
Spacegroup name	P 1 21 1
Unit cell lengths	70.509, 49.320, 90.904
Unit cell angles	90.00, 111.70, 90.00

Refinement procedure

Resolution	44.419 - 1.600
R-factor	0.1744
Rwork	0.173
R-free	0.20460
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3jrp
RMSD bond length	0.011
RMSD bond angle	1.318
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.8.1_1168)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	100.000	100.000	1.610
High resolution limit [Å]	1.550	3.340	1.550
Rmerge	0.084	0.051	0.680
Number of reflections	82989
<I/σ(I)>	9.1
Completeness [%]	99.3	99.9	93.2
Redundancy	6.9	7.3	5.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	298	23% (w/v) PEG 3350, 200 mM calcium chloride, 200 mM sodium thiocyanate, 100 mM Tris buffer, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K