3QVN

Crystal Structure of cytosolic MnSOD3 from Candida albicans

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2010-11-19
Detector	RIGAKU RAXIS HTC
Wavelength(s)	1.5418
Spacegroup name	P 64 2 2
Unit cell lengths	77.134, 77.134, 120.080
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	44.650 - 2.600
R-factor	0.2145
Rwork	0.212
R-free	0.27260
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3lsu
RMSD bond length	0.003
RMSD bond angle	0.687
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER (2.1.4)
Refinement software	PHENIX (1.7_650)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	44.654	44.650	2.690
High resolution limit [Å]	2.600	5.600	2.600
Rmerge	0.179	0.081	0.743
Number of reflections	6933
<I/σ(I)>	8.3
Completeness [%]	99.0	97.8	100
Redundancy	36.4	30.7	38.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	277	0.1M MgCl2, 0.1M NaCl, 0.1M Trisodium Citrate, 30% PEG 400, pH 5.5, vapor diffusion, hanging drop, temperature 277K