4LII

Crystal structure of an apoptosis-inducing factor, mitochondrion-associated, 1 (AIFM1) from Homo sapiens at 1.88 A resolution

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-02-29
Detector	DECTRIS PILATUS 6M
Spacegroup name	P 1 21 1
Unit cell lengths	50.680, 89.807, 60.471
Unit cell angles	90.00, 94.78, 90.00

Refinement procedure

Resolution	44.903 - 1.880
R-factor	0.169
Rwork	0.167
R-free	0.21120
Structure solution method	SAD
RMSD bond length	0.011
RMSD bond angle	1.489
Data reduction software	XDS
Data scaling software	XSCALE (December 29, 2011)
Phasing software	SHELX
Refinement software	REFMAC (5.7.0032)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	44.903	44.903	1.950
High resolution limit [Å]	1.880	4.040	1.880
Rmerge	0.112	0.051	0.872
Number of reflections	42757	4310	4415
<I/σ(I)>	7.73	19.2	1.6
Completeness [%]	97.4	95.3	97.4
Redundancy	3.5		3.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	277	20.00% polyethylene glycol 6000, 0.1M MES pH 6.0, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K