4U0D

Hexameric HIV-1 CA in complex with Nup153 peptide, P212121 crystal form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-01-20
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.92
Spacegroup name	P 21 21 21
Unit cell lengths	135.380, 138.060, 211.850
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	115.670 - 3.000
R-factor	0.2468
Rwork	0.246
R-free	0.26700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3h47
RMSD bond length	0.004
RMSD bond angle	0.651
Data reduction software	iMOSFLM
Data scaling software	Aimless (0.2.7)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.070	46.070	3.060
High resolution limit [Å]	3.000	15.300	3.000
Rmerge	0.101	0.021	0.664
Rpim		0.014	0.436
Total number of observations		2154	13499
Number of reflections	77432
<I/σ(I)>	8.6	33.8	1.7
Completeness [%]		95.1	97.3
Redundancy	3.2	3.3	3.1
CC(1/2)		0.999	0.577

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	290	10% w/v PEG 8K, 0.1M imidazole