5GU7

Crystal Structure of human ERp44 form II

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	100
Detector technology	CCD
Collection date	2015-04-18
Detector	RAYONIX MX300HE
Wavelength(s)	0.9
Spacegroup name	P 31 2 1
Unit cell lengths	84.150, 84.150, 133.180
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.913 - 2.050
R-factor	0.2017
Rwork	0.200
R-free	0.23540
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2r2j
RMSD bond length	0.007
RMSD bond angle	0.852
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.913	2.100
High resolution limit [Å]	2.050	2.050
Rmerge	0.063	1.176
Number of reflections	34847
<I/σ(I)>	26	2.3
Completeness [%]	99.9	100
Redundancy	17.1	11.24
CC(1/2)	0.999	0.764

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	277	Na/K tartrate