3WO6

Crystal structure of YidC from Bacillus halodurans (form I)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL32XU
Synchrotron site	SPring-8
Beamline	BL32XU
Temperature [K]	100
Detector technology	CCD
Collection date	2012-12-05
Detector	RAYONIX MX225HE
Wavelength(s)	1.000
Spacegroup name	P 1 21 1
Unit cell lengths	43.926, 60.631, 58.903
Unit cell angles	90.00, 100.35, 90.00

Refinement procedure

Resolution	28.297 - 2.403
R-factor	0.2429
Rwork	0.242
R-free	0.25870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	SeM-substituted protein structure
RMSD bond length	0.002
RMSD bond angle	0.714
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHENIX ((Phaser-MR))
Refinement software	PHENIX (1.7.2_869)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.440
High resolution limit [Å]	2.400	6.510	2.400
Rmerge	0.068	0.042	0.318
Number of reflections	10889
<I/σ(I)>	15.2
Completeness [%]	91.0	90.4	85.6
Redundancy	2.6	3.1	1.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	lipidic qubic phase	6	293	28-32% PEG500DME, 2. mM CdCl2, 100mM Na-(CH3)2AsO2, pH 6.0, lipidic qubic phase, temperature 293K