7LRI

Structure of HIV-1 Reverse Transcriptase in complex with DNA, dTTP, and CA(2+) ion

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE F1
Synchrotron site	CHESS
Beamline	F1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-25
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.977
Spacegroup name	P 1 21 1
Unit cell lengths	89.423, 131.073, 129.847
Unit cell angles	90.00, 101.55, 90.00

Refinement procedure

Resolution	47.180 - 3.050
R-factor	0.2119
Rwork	0.211
R-free	0.24360
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5d3g
RMSD bond length	0.003
RMSD bond angle	0.566
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.100
High resolution limit [Å]	3.050	3.050
Rmerge	0.121	0.010
Rmeas	0.127	0.010
Rpim	0.052	0.464
Number of reflections	55508	2697
<I/σ(I)>	14.22	1.44
Completeness [%]	99.1	96.5
Redundancy	6.6	5.3
CC(1/2)	0.912	0.597

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.2	277	10-12% PEG 8000, 50 MM BISTRIS-PROPANE PH 7.2, 50 MM AMMONIUM SULFATE, 5% GLYCEROL, 5% SUCROSE