6DJQ

Vps1 GTPase-BSE fusion complexed with GDP.AlF4-

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2017-10-04
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.96922
Spacegroup name	P 1 21 1
Unit cell lengths	69.060, 121.220, 104.560
Unit cell angles	90.00, 90.60, 90.00

Refinement procedure

Resolution	39.595 - 3.100
R-factor	0.225
Rwork	0.222
R-free	0.27850
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3zyc
RMSD bond length	0.003
RMSD bond angle	0.591
Data reduction software	MOSFLM (7.2.1)
Data scaling software	Aimless (0.5.14)
Phasing software	PHASER (2.5.6)
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.410	3.290
High resolution limit [Å]	3.100	3.100
Rmerge	0.098	0.505
Rmeas	0.134	0.411
Rpim	0.091	0.474
Number of reflections	26055	3987
<I/σ(I)>	8.2	2
Completeness [%]	84.4	79.9
Redundancy	2	2
CC(1/2)	0.980	0.516

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	5-10% PEG8000, 20% glycerol, 0.08 M MES, pH 5.6-6.2