5A3W

Crystal structure of human PLU-1 (JARID1B) in complex with Pyridine-2, 6-dicarboxylic Acid (PDCA)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-02-28
Detector	DECTRIS PILATUS 6M
Spacegroup name	P 65 2 2
Unit cell lengths	142.102, 142.102, 152.256
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.846 - 2.000
R-factor	0.1858
Rwork	0.184
R-free	0.21610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	51AF
RMSD bond length	0.008
RMSD bond angle	1.111
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	CCP4-AUTOMR
Refinement software	PHENIX ((PHENIX.REFINE))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.850	2.110
High resolution limit [Å]	2.000	2.000
Rmerge	0.130	0.940
Number of reflections	61492
<I/σ(I)>	15.7	3.7
Completeness [%]	99.9	100
Redundancy	19.9	19.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		8		0.1M HEPES PH 8.0, 0.8M POTASSIUM PHOSPHATE-DIBASIC, 0.8M SODIUM PHOSPHATE MONOBASIC