6UKI

HhaI endonuclease in Complex with DNA in space group P212121 (pH 6.0)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-02-12
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.00000
Spacegroup name	P 21 21 21
Unit cell lengths	94.411, 94.998, 97.868
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.970 - 2.700
R-factor	0.1818
Rwork	0.180
R-free	0.22410
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6uke
RMSD bond length	0.004
RMSD bond angle	0.689
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.980	2.790
High resolution limit [Å]	2.690	2.690
Rmerge	0.216	1.749
Rpim	0.078	0.757
Number of reflections	45835	4545
<I/σ(I)>	11.2	2.3
Completeness [%]	99.9	99.8
Redundancy	8.1	5.2
CC(1/2)		0.505

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		292	10% v/v 2-propanol, 0.1 M MES/sodium hydroxide, pH 6.0, 0.2 M calcium acetate