4QQX

Crystal structure of T. fusca Cas3-ATP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	CCD
Detector	ADSC QUANTUM 315
Spacegroup name	P 1 21 1
Unit cell lengths	87.250, 222.807, 125.087
Unit cell angles	90.00, 104.10, 90.00

Refinement procedure

Resolution	46.980 - 3.340
R-factor	0.1733
Rwork	0.172
R-free	0.22660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4qqw
RMSD bond length	0.015
RMSD bond angle	1.561
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.8.2_1309)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.490
High resolution limit [Å]	3.340	3.340
Rmerge	0.064	0.412
Number of reflections	66466
<I/σ(I)>	9.3	2.6
Completeness [%]	99.2	99.6
Redundancy	2.2	2.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	294	100 mM MES, pH 6.5, and 5% 10% (w/v) PEG 8000, VAPOR DIFFUSION, HANGING DROP, temperature 294.0K
1	VAPOR DIFFUSION, HANGING DROP	6.5	294	100 mM MES, pH 6.5, and 5% 10% (w/v) PEG 8000, VAPOR DIFFUSION, HANGING DROP, temperature 294.0K