6P1X

Structure of HIV-1 Reverse Transcriptase (RT) in complex with dsDNA and L-ddCTP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-04-29
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9793
Spacegroup name	C 2 2 21
Unit cell lengths	169.213, 171.502, 107.306
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.749 - 2.553
R-factor	0.19
Rwork	0.188
R-free	0.23040
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6or7
RMSD bond length	0.007
RMSD bond angle	0.951
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.710
High resolution limit [Å]	2.550	2.550
Number of reflections	97351	15225
<I/σ(I)>	12.13	2.2
Completeness [%]	99.4	96.8
Redundancy	7.1	6.8
CC(1/2)	0.997	0.837

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	6-10% (w/v) PEG 8000, 15 mM magnesium sulfate, and 50 mM MES adjusted at pH 6.0