1LF8

Complex of GGA3-VHS Domain and CI-MPR C-terminal Phosphopeptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	95
Detector technology	IMAGE PLATE
Collection date	2001-10-25
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.5418
Spacegroup name	C 2 2 21
Unit cell lengths	124.540, 129.700, 108.580
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 * - 2.300
Rwork	0.211
R-free	0.25500
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	1juq
RMSD bond length	0.006
RMSD bond angle	19.400 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000 *	2.380
High resolution limit [Å]	2.300	2.300
Rmerge	0.062	0.356
Number of reflections	37720
<I/σ(I)>	20.5	4.4
Completeness [%]	96.1	91.5
Redundancy	6.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8 *	20 *	100mM CAPS 10.2-11.0, 200 mM Lithium Sulfate, 1.3-2M Sodium/Potassium phosphate, VAPOR DIFFUSION, HANGING DROP, temperature 293K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop		50 (mM)
2	1	drop	Tris-HCl	20 (mM)	pH8.0
3	1	drop	dithiothreitol	10 (mM)
4	1	reservoir	CAPS	100 (mM)	pH10.2-11.0
5	1	reservoir		200 (mM)
6	1	reservoir	sodium potassium phosphate	1.4-1.7 (M)