1FFP

CRYSTAL STRUCTURE OF MURINE CLASS I H-2DB COMPLEXED WITH PEPTIDE GP33 (C9M/K1S)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	1999-09-18
Detector	RIGAKU RAXIS IIC
Spacegroup name	P 1
Unit cell lengths	47.013, 66.897, 80.414
Unit cell angles	75.10, 72.90, 69.28

Refinement procedure

Resolution	50.000 - 2.600
Rwork	0.250
R-free	0.30300
RMSD bond length	0.008
RMSD bond angle	25.500 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (0.5)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.760
High resolution limit [Å]	2.600	2.600
Rmerge	0.094	0.357 *
Total number of observations	109795 *
Number of reflections	25600
<I/σ(I)>	9.01
Completeness [%]	96.9	95.2
Redundancy	2	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	25% PEG 8000, 6% DMSO, 0.8M Glycine, 150mM NaCl 25mM MES buffer, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	10 (mg/ml)
2	1	drop	MES	25 (mM)	pH6.5
3	1	reservoir	PEG8000	10-20 (%)
4	1	reservoir	MES	25 (mM)	pH6.5
5	1	reservoir	dioxane	1 (%)