7DYN

Phosphorylation of MHC I peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-1
Synchrotron site	ESRF
Beamline	ID14-1
Temperature [K]	100
Detector technology	FILM
Collection date	2010-07-20
Detector	RIGAKU
Wavelength(s)	1.54178
Spacegroup name	P 21 21 21
Unit cell lengths	50.829, 82.297, 109.454
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.890 - 2.000
R-factor	0.17
Rwork	0.168
R-free	0.20800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2bst
RMSD bond length	0.007
RMSD bond angle	0.874
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.070
High resolution limit [Å]	2.000	2.000
Rmerge	0.089	0.366
Number of reflections	215220	215220
<I/σ(I)>	4.844
Completeness [%]	97.8
Redundancy	6.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.2 M Ammonium acetate, 0.1 M HEPES (pH 7.5), 25% (w/v) PEG 3,350