4U0A

Hexameric HIV-1 CA in complex with CPSF6 peptide, P6 crystal form

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	2012-07-06
Detector	PSI PILATUS 6M
Wavelength(s)	0.96860
Spacegroup name	P 6
Unit cell lengths	91.549, 91.549, 57.001
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	79.280 - 2.050
R-factor	0.2147
Rwork	0.213
R-free	0.25250
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3h47
RMSD bond length	0.004
RMSD bond angle	0.830
Data reduction software	iMOSFLM
Data scaling software	SCALA (3.3.20)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	79.284	46.281	2.160
High resolution limit [Å]	2.050	6.480	2.050
Rmerge		0.088	0.973
Rpim		0.038	0.419
Total number of observations		4027	17150
Number of reflections	17251
<I/σ(I)>	4.6	7.7	2
Completeness [%]	100.0	99.8	100
Redundancy	7.3	7	6.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	290	0.6M sodium potassium tartrate tetrahydrate, 0.1M TRIS