5ZM6

Crystal structure of ORP1-ORD in complex with PI(4,5)P2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2014-12-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97915
Spacegroup name	P 43 21 2
Unit cell lengths	188.661, 188.661, 64.585
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.033 - 2.700
R-factor	0.2456
Rwork	0.245
R-free	0.26350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ic4
RMSD bond length	0.010
RMSD bond angle	1.292
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.750
High resolution limit [Å]	2.700	2.700
Rmerge	0.094	0.621
Rmeas	0.098	0.692
Rpim	0.027	0.300
Number of reflections	32031	1451
<I/σ(I)>	37.41	2.83
Completeness [%]	96.4	89
Redundancy	11.7	4.8
CC(1/2)	0.998	0.669

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.7	293	100mM Sodium acetate, pH5.7, 1.4M Ammonium Tartrate