6B2V

Pyran synthase domain from module nine of the sorangicin pathway

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.3
Synchrotron site	ALS
Beamline	5.0.3
Temperature [K]	100
Detector technology	CCD
Collection date	2016-09-05
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	P 61 2 2
Unit cell lengths	75.370, 75.370, 195.870
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.000 - 1.550
R-factor	0.20468
Rwork	0.204
R-free	0.21233
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0151)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000
High resolution limit [Å]	1.550	1.550
Number of reflections	47028
<I/σ(I)>	37.1
Completeness [%]	96.8
Redundancy	19

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	298	15 mg/mL protein in 1.7 M ammonium sulfate, 0.1 M Bis-Tris, pH 5.5