4YE7

N-terminal domain of Orf22, a Cydia pomonella granulovirus envelope protein

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2014-09-16
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.9779, 0.9794, 0.9537
Spacegroup name	P 21 21 21
Unit cell lengths	59.565, 61.212, 75.283
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.130 - 1.400
R-factor	0.183
Rwork	0.182
R-free	0.20710
Structure solution method	MAD
RMSD bond length	0.015
RMSD bond angle	1.641
Data reduction software	XDS
Data scaling software	Aimless (0.3.11)
Phasing software	SOLVE
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	47.490	47.490	1.420
High resolution limit [Å]	1.400	7.660	1.400
Rmerge	0.092	0.021	3.104
Rpim	0.025	0.007	0.877
Total number of observations	792724	4296	37051
Number of reflections	53936
<I/σ(I)>	25.3	127.1	1
Completeness [%]	98.2	97.8	93.7
Redundancy	14.7	10.9	14.5
CC(1/2)	1.000	1.000	0.339

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	291	10% PEG 8000, 0.02 M sodium formate, 0.02 M ammonium acetate, 0.02 M trisodium citrate, 0.02 M sodium potassium L-tartrate, 0.0612 M MES, 0.0388 M imidazole, 20% ethylene glycol