9Y9K

HIV-1 Nef SF2 Core Domain Bound To The Human Hck SH3 Domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	CCD
Collection date	2018-01-24
Detector	RIGAKU SATURN 944
Wavelength(s)	1.541780
Spacegroup name	P 41 21 2
Unit cell lengths	80.712, 80.712, 82.362
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.240 - 2.340
R-factor	0.2432
Rwork	0.241
R-free	0.28400
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.475
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.240	2.580
High resolution limit [Å]	2.340	2.340
Rmerge	0.125	2.033
Rmeas	0.131	2.142
Rpim	0.036	0.660
Number of reflections	11899	2860
<I/σ(I)>	14.6	1
Completeness [%]	99.0	97.03
Redundancy	13	10.1
CC(1/2)	0.990	0.802

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298.15	0.162 M sodium nitrate, 16.2% w/v PEG3350, 2.7% v/v MPD, 2.5% v/v ethylene glycol