7K88

Crystal structure of bovine RPE65 in complex with hexaethylene glycol monooctyl ether

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-02-02
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.979300
Spacegroup name	P 65
Unit cell lengths	175.917, 175.917, 86.314
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.900 - 2.100
R-factor	0.19071
Rwork	0.189
R-free	0.22040
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	4rse
RMSD bond length	0.003
RMSD bond angle	1.204
Data reduction software	XDS
Data scaling software	XDS
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.230
High resolution limit [Å]	2.100	2.100
Rmerge	0.116	1.703
Number of reflections	88260	14309
<I/σ(I)>	8.3
Completeness [%]	99.4
Redundancy	5.2
CC(1/2)	0.996	0.373

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		281.15	Same as for entry 4RSE