3IWH

Crystal Structure of Rhodanese-like Domain Protein from Staphylococcus aureus

Replaces:  3EME

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2008-02-16
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9793, 0.9795
Spacegroup name	P 21 21 21
Unit cell lengths	41.412, 51.995, 58.971
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	15.620 - 2.000
R-factor	0.193
Rwork	0.191
R-free	0.23400
Structure solution method	MAD
RMSD bond length	0.017
RMSD bond angle	1.488
Data reduction software	HKL-2000
Data scaling software	HKL-3000
Phasing software	CNS
Refinement software	REFMAC (5.5.0072)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.000	2.070
High resolution limit [Å]	2.000	2.000
Rmerge	0.075	0.270
Number of reflections	8559
<I/σ(I)>	11.2	2.8
Completeness [%]	98.9	97.1
Redundancy	5.3	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1