7XUB

Structure of G9a in complex with compound 10d

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	CCD
Collection date	2012-10-19
Detector	RIGAKU SATURN A200
Wavelength(s)	1.000
Spacegroup name	P 1 21 1
Unit cell lengths	56.571, 77.464, 68.111
Unit cell angles	90.00, 90.44, 90.00

Refinement procedure

Resolution	38.050 - 2.000
R-factor	0.1796
Rwork	0.178
R-free	0.21480
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7xua
RMSD bond length	0.006
RMSD bond angle	0.955
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158+SVN)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.030
High resolution limit [Å]	2.000	2.000
Number of reflections	40123	2004
<I/σ(I)>	19.5	2.4
Completeness [%]	100.0
Redundancy	7.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1M Bis-Tris propane (7.75), 0.2M Sodium Formate, 10% Ethylene Glycol, 26% PEG3350