5ZB9

Crystal structure of Rtt109 from Aspergillus fumigatus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-06-21
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9786
Spacegroup name	P 21 21 21
Unit cell lengths	81.185, 92.019, 98.370
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.185 - 2.502
R-factor	0.1684
Rwork	0.166
R-free	0.20920
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2zfn
RMSD bond length	0.005
RMSD bond angle	0.846
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.590
High resolution limit [Å]	2.500	5.380	2.500
Rmerge	0.140	0.089	0.726
Rmeas	0.151	0.097	0.783
Rpim	0.057	0.038	0.290
Number of reflections	26067	2783	2566
<I/σ(I)>	5
Completeness [%]	100.0	99.8	100
Redundancy	6.9	6.5	7.1
CC(1/2)		0.991	0.800

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.4	289	100mM sodium cacodylate, pH 6.4, 16% PEG 1500