6IQ1

Crystal structure of histidine triad nucleotide-binding protein from Candida albicans

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2015-11-17
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.2818
Spacegroup name	P 2 21 21
Unit cell lengths	40.354, 101.907, 175.175
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.926 - 2.485
R-factor	0.1908
Rwork	0.188
R-free	0.22780
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ksv
RMSD bond length	0.007
RMSD bond angle	0.928
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.590
High resolution limit [Å]	2.485	2.500
Rmerge	0.109	0.413
Number of reflections	48467
<I/σ(I)>	35.2
Completeness [%]	100.0
Redundancy	7.5
CC(1/2)		0.972

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	0.2 M magnesium acetate, 0.1 M sodium cacodylate [pH 6.5], 20% PEG 8000; 20% PEG 3350, 0.2 M magnesium acetate