7S09

Crystal structure of Penicillium verruculosum copalyl diphosphate synthase (PvCPS) alpha prenyltransferase domain variant, F760A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-01-21
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	P 3 2 1
Unit cell lengths	187.749, 187.749, 56.404
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	93.870 - 3.100
R-factor	0.2103
Rwork	0.199
R-free	0.25500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6v0k
RMSD bond length	0.009
RMSD bond angle	1.133
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	93.870	3.211
High resolution limit [Å]	3.100	3.100
Number of reflections	69339	20936
<I/σ(I)>	6.7	1.5
Completeness [%]	100.0
Redundancy	17.8
CC(1/2)	0.924	0.544

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		294	0.1 M sodium citrate pH 5.6 0.015 M sodium citrate tribasic dihydrate 2.5% tacsimate pH 5.0 21% PEG 3350