5TBI

Crystal structure of mouse CARM1 in complex with inhibitor LH1427

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-09-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97857
Spacegroup name	P 21 21 2
Unit cell lengths	74.494, 98.029, 205.730
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.544 - 2.294
R-factor	0.1993
Rwork	0.198
R-free	0.22840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ih3
RMSD bond length	0.004
RMSD bond angle	0.855
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (dev_1951)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.010	2.350
High resolution limit [Å]	2.290	2.290
Rmerge	0.163	1.152
Number of reflections	67916
<I/σ(I)>	6.9	1.2
Completeness [%]	99.3	92.3
Redundancy	4.4	4.1
CC(1/2)	0.991

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	Tris-HCl pH 8.0 100 mM PEG 2000 MME 21% NaCl 100 mM