1M1D

TETRAHYMENA GCN5 WITH BOUND BISUBSTRATE ANALOG INHIBITOR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	95
Detector technology	CCD
Collection date	2001-02-22
Detector	CUSTOM-MADE
Wavelength(s)	1.0082
Spacegroup name	P 21 21 21
Unit cell lengths	67.420, 67.830, 74.500
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.300 * - 2.200
R-factor	0.26
Rwork	0.213
R-free	0.26520 *
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1qsn
RMSD bond length	0.009 *
RMSD bond angle	1.750 *
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.300 *	2.280
High resolution limit [Å]	2.200 *	2.200
Rmerge	0.059 *	0.346 *
Number of reflections	26519
Completeness [%]	99.2 *	97.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.6	20 *	Ammonium sulfate, sodium cacodylate, sodium chloride, pH 6.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	0.36 (mM)
2	1	drop	inhibitor	0.58 (mM)
3	1	reservoir	ammonium sulfate	2.0 (M)
4	1	reservoir	sodium cacodylate	0.1 (M)	pH6.6
5	1	reservoir		0.2 (M)