4XFY

Structure of the native full-length dehydrated HIV-1 capsid protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CMOS
Collection date	2014-03-25
Detector	RDI CMOS_8M
Wavelength(s)	1.00012
Spacegroup name	P 6
Unit cell lengths	87.137, 87.137, 55.881
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	45.000 - 2.800
R-factor	0.2099
Rwork	0.208
R-free	0.25010
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3h47
RMSD bond length	0.008
RMSD bond angle	1.121
Data scaling software	Aimless (0.1.29)
Phasing software	PHASER (2.5.2)
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	55.880	55.880	2.960
High resolution limit [Å]	2.790	8.380	2.790
Rmerge	0.105	0.027	1.269
Rpim	0.034	0.009	0.425
Total number of observations	65579	2528	9367
Number of reflections	6091
<I/σ(I)>	19.8	67.1	1.8
Completeness [%]	99.7	99.6	98.2
Redundancy	10.8	10.2	9.8
CC(1/2)	0.999	1.000	0.704

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	PEG3350, NaI, Sodium cacodylate