8JYI

Crystal structure of engineered HIV-1 Reverse Transcriptase RNase H domain complexed with laccaic acid E

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-17A
Synchrotron site	Photon Factory
Beamline	BL-17A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-06-27
Detector	DECTRIS EIGER X 4M
Wavelength(s)	1.0000
Spacegroup name	P 41 21 2
Unit cell lengths	61.693, 61.693, 83.234
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.620 - 1.920
R-factor	0.22
Rwork	0.216
R-free	0.25270
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	1.173
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.620	1.970
High resolution limit [Å]	1.920	1.920
Rmerge	0.051	0.985
Rmeas	0.053	1.027
Rpim	0.015	0.287
Total number of observations	163286	10472
Number of reflections	12860	835
<I/σ(I)>	21.5	1.7
Completeness [%]	99.9
Redundancy	12.7	12.5
CC(1/2)	0.999	0.664

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.6	291	0.1M MES, 26%(v/v) PEG6000, 0.01 M Zinc Sulfate, 0.001 M MANGANESE CHLORIDE