3CXL

Crystal structure of human chimerin 1 (CHN1)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2008-04-09
Detector	ADSC QUANTUM 315
Wavelength(s)	0.99987
Spacegroup name	P 62
Unit cell lengths	152.187, 152.187, 69.529
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.513 - 2.600
R-factor	0.267
Rwork	0.266
R-free	0.30000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDB entries 1XA6 2osa
RMSD bond length	0.012
RMSD bond angle	1.053
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.640
High resolution limit [Å]	2.600	7.050	2.600
Rmerge	0.082	0.038	0.970
Number of reflections	29085
<I/σ(I)>	15
Completeness [%]	99.7	97.4	97.3
Redundancy	10.8	10	9.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	9.5	291	1.4M Ammonium sulfate, 0.1M Glycine, 0.01M Magnesium chloride, 5% MPD, pH 9.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K