5UC9

Crystal structure of human Heme Oxygenase-2 in complex with Myristate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	CCD
Collection date	2015-04-10
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97921
Spacegroup name	P 21 21 21
Unit cell lengths	77.751, 82.900, 137.051
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.000 - 1.903
R-factor	0.1924
Rwork	0.188
R-free	0.24370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5uc8
RMSD bond length	0.008
RMSD bond angle	0.856
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.10_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	25.000	25.000	1.970
High resolution limit [Å]	1.900	4.090	1.900
Rmerge	0.058	0.024	0.534
Rmeas	0.067
Rpim	0.034
Total number of observations	246452
Number of reflections	68092
<I/σ(I)>	14.1
Completeness [%]	97.3	97	91.6
Redundancy	3.6	3.5	3.6
CC(1/2)		0.999	0.773

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	0.1 M Bis-Tris (pH 6.5) and 24% (w/v) PEG 2,000 monomethyl ether