4U0F

Hexameric HIV-1 CA in Complex with BI-2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2013-11-19
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 6
Unit cell lengths	90.880, 90.880, 56.580
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	14.870 - 2.220
R-factor	0.2431
Rwork	0.242
R-free	0.27010
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3h47
RMSD bond length	0.006
RMSD bond angle	0.918
Data reduction software	iMOSFLM
Data scaling software	Aimless (0.2.7)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	14.870	14.870	2.280
High resolution limit [Å]	2.210	8.840	2.210
Rmerge	0.177	0.036	0.499
Rpim	0.096	0.020	0.294
Total number of observations	48198	626	3057
Number of reflections	12460
<I/σ(I)>	7.2	24.7	3
Completeness [%]	93.4	71.9	72.5
Redundancy	3.9	4	3.4
CC(1/2)	0.986	0.998	0.476

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	290	12% w/v PEG 4K, 0.1 M TRIS pH 8.5, 3% v/v ethylene glycol