3NJY

Crystal structure of JMJD2A complexed with 5-carboxy-8-hydroxyquinoline

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	CCD
Collection date	2009-12-14
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97860
Spacegroup name	P 21 21 2
Unit cell lengths	100.550, 148.990, 56.910
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.678 - 2.600
R-factor	0.1823
Rwork	0.180
R-free	0.22590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2oq6
RMSD bond length	0.015
RMSD bond angle	1.097
Data reduction software	MOSFLM
Data scaling software	SCALA (CCP4_3.3.16)
Phasing software	PHASER
Refinement software	PHENIX (1.6_289)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	41.240	41.240	2.740
High resolution limit [Å]	2.600	8.220	2.600
Rmerge	0.111	0.070	0.400
Total number of observations		3821	16405
Number of reflections	26805
<I/σ(I)>	9.4073
Completeness [%]	99.0	97.08	97.09
Redundancy	4.44	4.13	4.37

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	277	0.1M CITRATE, 4mM NiCl2, 20% PEG 3350, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K