2YKZ

RECOMBINANT NATIVE CYTOCHROME C PRIME FROM ALCALIGENES XYLOSOXIDANS AT 0.84 A RESOLUTION: RESTRAINED REFINEMENT

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2008-04-07
Detector	DECTRIS PILATUS 6M
Spacegroup name	P 65 2 2
Unit cell lengths	53.470, 53.470, 181.190
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.510 - 0.840
R-factor	0.10615
Rwork	0.106
R-free	0.11602
Structure solution method	OTHER
Starting model (for MR)	NONE
RMSD bond length	0.019
RMSD bond angle	2.038
Data reduction software	XDS
Data scaling software	XDS
Refinement software	REFMAC (5.5.0106)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.000	0.900
High resolution limit [Å]	0.840	0.840
Rmerge	0.040	0.780
Number of reflections	128930
<I/σ(I)>	10.5	2.12
Completeness [%]	92.2	72.8
Redundancy	6	5.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.5		AMMONIUM SULPHATE, TRIS PH 7.5 .