6ZUD

Cu nitrite reductase from Achromobacter cycloclastes: MSOX series at 170K, dose point 3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	170
Detector technology	PIXEL
Collection date	2010-07-08
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.7
Spacegroup name	P 21 3
Unit cell lengths	95.355, 95.355, 95.355
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.960 - 1.100
R-factor	0.125
Rwork	0.123
R-free	0.15500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2bw4
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	REFMAC
Refinement software	SHELX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.600	1.160
High resolution limit [Å]	1.100	1.100
Rpim	0.037	0.332
Number of reflections	115774	16660
<I/σ(I)>	8.5	1.9
Completeness [%]	99.4	98.7
Redundancy	4.9	4.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.75	293	1.6M AMMONIUM SULPHATE, 100MM REMARK 280 SODIUM ACETATE, PH 4.75