5FCC

Structure of HutD from Pseudomonas fluorescens SBW25 (NaCl condition)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	110
Detector technology	CCD
Collection date	2010-12-15
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.953692
Spacegroup name	P 41 21 2
Unit cell lengths	81.998, 81.998, 169.901
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	54.870 - 1.940
R-factor	0.202
Rwork	0.200
R-free	0.23600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ESG
RMSD bond length	0.010
RMSD bond angle	1.116
Data scaling software	SCALA (3.3.22)
Phasing software	MOLREP
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	81.998	81.998	2.040
High resolution limit [Å]	1.940	6.130	1.940
Rmerge		0.036	2.870
Rpim		0.007	0.611
Total number of observations		39780	138782
Number of reflections	43842
<I/σ(I)>	21.3	80.2	1.3
Completeness [%]	100.0	100	100
Redundancy	26.7	25	22.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	291	Imidazole pH 6.5, 3 M NaCl, 150mM FG