2IC2

Crystal Structure of the First FNIII Domain of Ihog

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4A
Synchrotron site	NSLS
Beamline	X4A
Detector technology	CCD
Collection date	2004-05-03
Detector	ADSC QUANTUM 4
Wavelength(s)	0.9792, 0.9794, 0.9724
Spacegroup name	P 21 21 21
Unit cell lengths	39.511, 39.480, 127.666
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.900 - 1.300
Rwork	0.215
R-free	0.23400
Structure solution method	MAD
RMSD bond length	0.006
RMSD bond angle	1.495
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SOLVE
Refinement software	CNS

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	30.000	30.000	1.350
High resolution limit [Å]	1.300	2.800	1.300
Rmerge	0.077	0.069	0.228
Number of reflections	45209
<I/σ(I)>	13.6
Completeness [%]	90.0	85.2	67.2
Redundancy	8.3	10.3	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	3.2	293	0.05M Citrate pH 3.2, 26% PEG 3350, 0.1M ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 293K
1	VAPOR DIFFUSION, HANGING DROP	3.2	293	0.05M Citrate pH 3.2, 26% PEG 3350, 0.1M ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 293K
1	VAPOR DIFFUSION, HANGING DROP	3.2	293	0.05M Citrate pH 3.2, 26% PEG 3350, 0.1M ammonium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 293K