5ISD

Crystal structure of mouse CARM1 in complex with inhibitor SA0592

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	CCD
Collection date	2011-07-03
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9184
Spacegroup name	P 21 21 2
Unit cell lengths	74.555, 98.446, 205.792
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.996 - 2.601
R-factor	0.1943
Rwork	0.193
R-free	0.22630
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ih3
RMSD bond length	0.006
RMSD bond angle	1.090
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (dev_1951)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.690
High resolution limit [Å]	2.600	2.600
Number of reflections	47090
<I/σ(I)>	24.1	4.4
Completeness [%]	99.4	98.5
Redundancy	6.4	5.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	290	Tris-HCl pH 8.0 100 mM PEG 2000 MME 19 % NaCl 133 mM