4Y1K

PALMITOYLATED OPRM OUTER MEMBRANE FACTOR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	80
Detector technology	CCD
Collection date	2004-11-25
Detector	ADSC QUANTUM 210
Spacegroup name	C 1 2 1
Unit cell lengths	152.642, 87.858, 355.942
Unit cell angles	90.00, 98.94, 90.00

Refinement procedure

Resolution	87.910 - 3.800
R-factor	0.299
Rwork	0.297
R-free	0.34600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3d5k
RMSD bond length	0.010
RMSD bond angle	1.405
Data reduction software	iMOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	88.000	4.010
High resolution limit [Å]	3.800	3.800
Rmerge		0.312
Number of reflections	40566
<I/σ(I)>	8.5	3.3
Completeness [%]	87.7	77.9
Redundancy	3.2	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5	291	100 MM SODIUM ACETATE (PH 4.5), 6% PEG 20 000 (W/V), 300 MM AMMONIUM CITRATE, 25-30% GLYCEROL (V/V) 0.9% BETAOG