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NDB ID: 5UOQ    PDB ID: 5UOQ 


Title:

CRYSTAL STRUCTURE OF THE PROTOTYPE FOAMY VIRUS INTASOME WITH A 2- PYRIDINONE AMINAL INHIBITOR (COMPOUND 31)

Molecular Description:

Pro-Pol polyprotein/DNA Complex

Structural Keywords:

B DOUBLE HELIX

Nucleic Acid Sequence:

Click to show/hide 2 nucleic acid sequences

Protein Sequence:

Click to show/hide 1 protein sequences

Primary Citation:

Schreier, J.D., Embrey, M.W., Raheem, I.T., Barbe, G., Campeau, L.C., Dubost, D., McCabe Dunn, J., Grobler, J., Hartingh, T.J., Hazuda, D.J., Klein, D., Miller, M.D., Moore, K.P., Nguyen, N., Pajkovic, N., Powell, D.A., Rada, V., Sanders, J.M., Sisko, J., Steele, T.G., Wai, J., Walji, A., Xu, M., Coleman, P.J.
Discovery and optimization of 2-pyridinone aminal integrase strand transfer inhibitors for the treatment of HIV. 
Bioorg. Med. Chem. Lett., 27, pp. 2038 - 2046, 2017.

Experimental Information:

X-RAY DIFFRACTION

Space Group:

P 41 21 2

Cell Constants:

a = 159.51   b = 159.51   c = 123.82 (Ångstroms)

α = 90.0   β = 90.0   γ = 90.0 (degrees)

Refinement:

The structure was refined using the BUSTER program. The R value is 0.2 for 49023 reflections in the resolution range 37.96 to 2.61 Ångstroms with Fobs >  0.0 sigma(Fobs) and with I >  0.0 sigma(I)