4RSC

Crystal structure of RPE65 in complex with emixustat and palmitate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2014-04-25
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0750
Spacegroup name	P 65
Unit cell lengths	175.891, 175.891, 86.533
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.930 - 1.800
R-factor	0.16623
Rwork	0.165
R-free	0.19569
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3fsn
RMSD bond length	0.014
RMSD bond angle	1.549
Data reduction software	XDS
Data scaling software	XDS
Phasing software	REFMAC
Refinement software	REFMAC

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	1.800
Number of reflections	139163
Completeness [%]	99.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	281	30% PEG200 200 mM ammonium phosphate 100 mM Tris, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 281K