6DEF

Vps1 GTPase-BSE fusion complexed with GMPPCP

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	PIXEL
Collection date	2018-03-29
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	82.659, 118.740, 84.140
Unit cell angles	90.00, 99.30, 90.00

Refinement procedure

Resolution	40.786 - 2.260
R-factor	0.1947
Rwork	0.193
R-free	0.22530
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3zyc
RMSD bond length	0.002
RMSD bond angle	0.527
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.790	2.310
High resolution limit [Å]	2.260	2.260
Rmerge	0.068	0.445
Rmeas	0.080	0.590
Rpim	0.042	0.316
Number of reflections	69139	4347
<I/σ(I)>	10.6	2.1
Completeness [%]	92.4	90.5
Redundancy	3.6	3.4
CC(1/2)	0.997	0.860

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		294	14% PEG4000, 0.2 M sodium acetate, 0.1 M Tris-Cl, pH 8.7-9.0