2WWJ

STRUCTURE OF JMJD2A COMPLEXED WITH INHIBITOR 10A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	CCD
Collection date	2009-02-07
Detector	ADSC CCD
Spacegroup name	P 21 21 2
Unit cell lengths	101.330, 148.970, 57.110
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.970 - 2.600
R-factor	0.18104
Rwork	0.178
R-free	0.24758
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2oq6
RMSD bond length	0.016
RMSD bond angle	1.649
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	REFMAC
Refinement software	REFMAC (5.5.0066)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.750	2.740
High resolution limit [Å]	2.600	2.600
Rmerge	0.130	0.590
Number of reflections	27338
<I/σ(I)>	12.2	3.37
Completeness [%]	99.9	99.6
Redundancy	6.64	6.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.5		PROTEIN STOCK 11MG/ML JMJD2A, 10MM HEPES PH7.5, 500MM NACL, 5% GLYCEROL, 0.75MM INHIBITOR 10A. RESERVOIR: 0.1M CITRATE PH5.5, 18.5% PEG3350, 4MM NICL2. 1:1 PROTEIN/RESERVOIR