4UWV

Lysozyme soaked with a ruthenium based CORM with a pyridine ligand (complex 8)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-2
Synchrotron site	ESRF
Beamline	ID14-2
Temperature [K]	100
Detector technology	CCD
Collection date	2009-09-18
Detector	ADSC CCD
Spacegroup name	P 43 21 2
Unit cell lengths	80.220, 80.220, 37.160
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.260 - 1.770
R-factor	0.183
Rwork	0.181
R-free	0.22198
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	193l
RMSD bond length	0.019
RMSD bond angle	1.807
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.260	1.860
High resolution limit [Å]	1.770	1.770
Rmerge	0.060
Number of reflections	11793
Completeness [%]	100.0	99.9
Redundancy	13.8	13.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	2-10% (M/V) NACL IN 0.1 M ACETATE BUFFER PH 4.5. PROTEIN STOCK CONCENTRATION OF 50 MG/ML. HANGING DROP VAPOR DIFFUSION METHOD, 293K