7CAR

Versatile cis-prenyltransferase MM_0014 from Methanosarcina mazei (crystal type: free+IPP)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	CCD
Collection date	2017-12-12
Detector	ADSC QUANTUM 270
Wavelength(s)	1.000
Spacegroup name	C 2 2 21
Unit cell lengths	79.940, 100.420, 129.560
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.720 - 1.980
R-factor	0.22145
Rwork	0.220
R-free	0.25878
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7caq
RMSD bond length	0.009
RMSD bond angle	1.504
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.800	2.090
High resolution limit [Å]	1.980	1.980
Rmerge	0.071	0.660
Number of reflections	36516	5267
<I/σ(I)>	22.1
Completeness [%]	99.8
Redundancy	14
CC(1/2)	0.999	0.856

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	4 mM cobalt (II) chloride, 4 mM nickel (II) chloride, 4 mM cadmium chloride, 4 mM magnesium chloride, 0.075 M HEPES, pH7.5, 9% PEG 3350, 25% glycerol