4IWX

Rimk structure at 2.85A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Detector technology	CCD
Collection date	2012-07-30
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.0
Spacegroup name	P 64 2 2
Unit cell lengths	129.802, 129.802, 171.239
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.986 - 2.854
R-factor	0.2181
Rwork	0.216
R-free	0.25650
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4iwy
RMSD bond length	0.010
RMSD bond angle	1.475
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SHELXS
Refinement software	PHENIX (1.8.1_1168)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.900
High resolution limit [Å]	2.850	7.730	2.850
Rmerge	0.111	0.053	0.639
Number of reflections	20166
<I/σ(I)>	7.4
Completeness [%]	98.7	99.5	88.7
Redundancy	15.7	14.4	8.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	100 mM HEPES, and 1.8 M ammonium sulfate , pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 291K