5CVE

Crystal Structure of human NRMT1 in complex with dimethylated fly H2B peptide and SAH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2015-06-10
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97914
Spacegroup name	C 1 2 1
Unit cell lengths	114.836, 66.302, 68.730
Unit cell angles	90.00, 106.44, 90.00

Refinement procedure

Resolution	32.118 - 1.500
R-factor	0.1534
Rwork	0.153
R-free	0.17950
RMSD bond length	0.005
RMSD bond angle	1.050
Data reduction software	SCALA
Data scaling software	HKL-2000
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.530
High resolution limit [Å]	1.500	4.070	1.500
Rmerge	0.097	0.050	0.817
Rmeas	0.105	0.054	0.879
Rpim	0.039	0.020	0.323
Total number of observations	577246
Number of reflections	78798
<I/σ(I)>	7.8
Completeness [%]	99.2	99.5	98
Redundancy	7.3	7.3	7.3
CC(1/2)		0.998	0.846

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.7	291	0.2 M (NH4)Ac, 0.1 M Sodium citrate tribasic dihydrate, 24%(w/v) PEG 4000