4Y9W

Aspartic Proteinase Sapp2 Secreted from Candida Parapsilosis at 0.82 A Resolution.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.2
Synchrotron site	BESSY
Beamline	14.2
Temperature [K]	100
Detector technology	CCD
Collection date	2011-06-01
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.91841
Spacegroup name	P 1 21 1
Unit cell lengths	48.260, 57.660, 54.360
Unit cell angles	90.00, 92.95, 90.00

Refinement procedure

Resolution	11.370 - 0.830
R-factor	0.1173
Rwork	0.117
R-free	0.12450
RMSD bond length	0.017
RMSD bond angle	1.913
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.16)
Phasing software	MOLREP
Refinement software	REFMAC (5.6.0117)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	11.368	11.376	0.850
High resolution limit [Å]	0.825	3.690	0.820
Rmerge		0.073	0.378
Rmeas	0.096
Rpim	0.032	0.030	0.289
Total number of observations	2124055	10579	43021
Number of reflections	261700
<I/σ(I)>	13.2	26.6	2
Completeness [%]	92.3	44.9	65.5
Redundancy	8.1	7.1	3.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	291	PEG 400