6AXR

Structure of the P122A mutant of the HIV-1 capsid protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-03-14
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.033203
Spacegroup name	P 6
Unit cell lengths	92.728, 92.728, 57.791
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.907 - 2.300
R-factor	0.2415
Rwork	0.240
R-free	0.26780
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4xfx
RMSD bond length	0.002
RMSD bond angle	0.508
Data reduction software	Aimless (0.5.32)
Data scaling software	Aimless (0.5.32)
Phasing software	PHASER (2.7.17)
Refinement software	PHENIX (1.11.1-2575_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.910	46.910	2.380
High resolution limit [Å]	2.300	8.910	2.300
Rmerge	0.060	0.046	0.633
Rmeas	0.066	0.051	0.699
Rpim	0.028	0.022	0.293
Number of reflections	12735	241	1251
<I/σ(I)>	14.9
Completeness [%]	99.9	99.3	100
Redundancy	5.7	5.5	5.6
CC(1/2)	0.998	0.998	0.833

Crystallization Conditions

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