1FL5

THE UNLIGANDED GERMLINE PRECURSOR TO THE SULFIDE OXIDASE CATALYTIC ANTIBODY 28B4.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Collection date	1999-11-05
Detector	ADSC QUANTUM 4
Spacegroup name	P 1
Unit cell lengths	36.420, 69.650, 85.310
Unit cell angles	74.56, 80.18, 77.55

Refinement procedure

Resolution	20.000 - 2.100
R-factor	0.226 *
Rwork	0.226
R-free	0.26800
RMSD bond length	0.010
RMSD bond angle	1.600
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (0.4)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.230
High resolution limit [Å]	2.100	2.070 *
Rmerge	0.051	0.221
Total number of observations	109371 *
Number of reflections	51231
<I/σ(I)>	18
Completeness [%]	96.9	95.2 *
Redundancy	2.5	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *	3.9	100 *	100 mM ammonium sulfate 50 mM sodium acetate 10% PEG 2000 MME, pH 3.9, VAPOR DIFFUSION, temperature 277.0K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	ammonium sulfate	100 (mM)
2	1	1	sodium acetate	50 (mM)	pH3.9
3	1	1	PEG MME2000	10 (%)