4R0B

Structure of dimeric human glycodelin

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	2013-07-25
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.91841
Spacegroup name	P 61 2 2
Unit cell lengths	57.003, 57.003, 198.641
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.500 - 2.450
R-factor	0.2021
Rwork	0.200
R-free	0.25660
RMSD bond length	0.007
RMSD bond angle	1.175
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	2.550
High resolution limit [Å]	2.450	10.000	2.450
Rmerge	0.071	0.027	0.800
Number of reflections	7678	146	835
<I/σ(I)>	26.51	61.98	3.91
Completeness [%]	99.9	95.4	100
Redundancy	13.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	25 %(w/v) PEG4000, 170 mM ammonium sulfate, 15 %(v/v) glycerol, VAPOR DIFFUSION, SITTING DROP, temperature 293K