9FH8

Crystal structure of the SPD-2 domain of Apis dorsata CEP192

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-13
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97903
Spacegroup name	I 41
Unit cell lengths	183.300, 183.300, 190.044
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.290 - 3.500
R-factor	0.2889
Rwork	0.287
R-free	0.31310
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.746
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.17.1_3660: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.480	3.640
High resolution limit [Å]	3.500	3.500
Rmerge	0.102	0.929
Rmeas	0.125
Rpim	0.072	0.669
Number of reflections	39530	4459
<I/σ(I)>	10.4	1.9
Completeness [%]	100.0	100
Redundancy	5.7	5.6
CC(1/2)	0.993	0.599

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		292.15	17% PEG3350, 0.25 M KCl