6KDS

Crystal structure of human NRMT2 in complex with alpha-N-monomethylated human CENP-A peptide

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	2014-05-21
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97915
Spacegroup name	P 21 21 2
Unit cell lengths	62.603, 108.191, 38.799
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.979 - 1.844
R-factor	0.1796
Rwork	0.178
R-free	0.20470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5cvd
Data reduction software	DENZO
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.14rc3_3206)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.830
High resolution limit [Å]	1.800	4.880	1.800
Rmerge	0.092	0.049	0.894
Rmeas	0.107	0.059
Rpim	0.060	0.032	0.572
Total number of observations	154647
Number of reflections	47754	2435	2391
<I/σ(I)>	10.8
Completeness [%]	98.1	97.1	99.7
Redundancy	3.2	3.2	3.4
CC(1/2)		0.994	0.408

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8.1	291	0.1M Tris pH 8.1, 14% w/v Polyethylene glycol 8000