5XHQ

Apolipoprotein N-acyl Transferase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-08-08
Detector	DECTRIS PILATUS 300K
Wavelength(s)	0.9793
Spacegroup name	P 21 21 21
Unit cell lengths	90.869, 134.094, 135.159
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.364 - 2.587
R-factor	0.2355
Rwork	0.233
R-free	0.28770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ems
RMSD bond length	0.013
RMSD bond angle	1.549
Data reduction software	HKL-2000 (2.2.0)
Data scaling software	HKL-2000 (2.2.0)
Phasing software	PHENIX (dev_1819)
Refinement software	PHENIX (dev_1819)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.400	2.640
High resolution limit [Å]	2.587	2.600
Rmerge	0.135	0.665
Number of reflections	51623	1457
<I/σ(I)>	14.8
Completeness [%]	100.0	100
Redundancy	7.2	6.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	50 mM Tris-HCl (pH 7.5) and 26% (v/v) PEG 550 MME