5UMB

Crystal structure of ATPase domain of Malaria GRP78 with ADP bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-07-31
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.9795
Spacegroup name	P 1 21 1
Unit cell lengths	84.531, 112.264, 93.157
Unit cell angles	90.00, 90.13, 90.00

Refinement procedure

Resolution	48.080 - 2.300
R-factor	0.229
Rwork	0.227
R-free	0.26500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5f1x
Data scaling software	HKL-2000
Refinement software	BUSTER (2.10.2)

Data quality characteristics

	Overall
Low resolution limit [Å]	48.080
High resolution limit [Å]	2.300
Number of reflections	76738
<I/σ(I)>	7.19
Completeness [%]	99.5
Redundancy	3.38

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293.15	30% PEG 8K, 0.2M NH4SO4, 0.1M Na CaCo, pH 6.5