4Q2D

Crystal Structure of CRISPR-Associated protein in complex with 2'-Deoxyadenosine 5'-Triphosphate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2013-10-30
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9793
Spacegroup name	C 2 2 21
Unit cell lengths	105.684, 211.630, 104.272
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.655 - 2.771
R-factor	0.2093
Rwork	0.207
R-free	0.24670
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4q2c
RMSD bond length	0.003
RMSD bond angle	0.849
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASES
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	100.000	2.850
High resolution limit [Å]	2.771	2.800
Number of reflections	28764
Completeness [%]	96.4	83.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	295	2.2M Sodium Chloride, 0.1M Sodium phosphate monobasic monohydrate, 0.1M Potassium phosphate monobasic, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K