7O6W

Crystal structure of (the) VEL1 VEL polymerising domain (I664D mutant)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-10-07
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979500
Spacegroup name	P 63
Unit cell lengths	79.259, 79.259, 59.957
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	27.490 - 2.640
R-factor	0.21527
Rwork	0.212
R-free	0.24916
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	1.012
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	CRANK2
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	27.490	10.000	2.770
High resolution limit [Å]	2.640	8.000	2.640
Rmerge	0.068	0.033	1.045
Rmeas	0.069	0.033	1.000
Rpim	0.011	0.050	0.183
Number of reflections	6333	186	782
<I/σ(I)>	37
Completeness [%]	98.8	97.2	92
Redundancy	20	15	15
CC(1/2)	1.000	1.000	0.842

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.25M (NH4)H2PO4