4M5S

Human alphaB crystallin core domain in complex with C-terminal peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	CCD
Collection date	2010-12-10
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9794
Spacegroup name	I 2 2 2
Unit cell lengths	35.380, 47.860, 122.840
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.569 - 1.370
R-factor	0.1579
Rwork	0.156
R-free	0.18740
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.016
RMSD bond angle	1.640
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.8.1_1168)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	19.569		1.410
High resolution limit [Å]	1.370	6.130	1.370
Rmerge	0.042	0.031	0.486
Number of reflections	21884	231	1558
<I/σ(I)>	25.13	45.23	3.33
Completeness [%]	97.5	76.5	96

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	298	0.1 M SPG, pH 6.0, 25% PEG1500, VAPOR DIFFUSION, HANGING DROP, temperature 298K