5WCI

Human MYST histone acetyltransferase 1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E SUPERBRIGHT
Temperature [K]	100
Detector technology	CCD
Collection date	2016-03-04
Detector	RIGAKU SATURN A200
Wavelength(s)	1.54178
Spacegroup name	P 21 21 21
Unit cell lengths	46.336, 58.729, 120.277
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 - 1.780
R-factor	0.1845
Rwork	0.183
R-free	0.21830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2giv
RMSD bond length	0.010
RMSD bond angle	1.344
Data reduction software	HKL-3000
Data scaling software	SCALEPACK
Phasing software	HKL-3000
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.810
High resolution limit [Å]	1.780	4.830	1.780
Rmerge	0.093	0.034	0.916
Rmeas	0.097	0.035	0.976
Rpim	0.026	0.010	0.327
Number of reflections	31768		1506
<I/σ(I)>	7.2
Completeness [%]	98.7	98.9	97.6
Redundancy	13.2	12.7	8.1
CC(1/2)		1.000	0.701

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	291	20% PEG 3350, 0.2 M Na malonate pH5.0