U.S. Department of Health and Human Services — National Institutes of Health

HIV-1 wild Type protease with GRL-011-11A (a methylamine bis-Tetrahydrofuran P2-Ligand, sulfonamide isostere derivate)

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Created on Tue, 2016-01-05 17:54, last updated on Tue, 2016-01-05 17:54

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General Information

This Model was autogenerated from the "Quick Submit" tool.

Model ID

3DPX-002566

Category

Proteins, Macromolecules and Viruses

Keyword(s)

HYDROLASE-HYDROLASE INHIBITOR complex

Protein Data Bank ID

Experimental Method

X-RAY DIFFRACTION

Resolution

1.34

Model Details

Associated Species

Escherichia coli

Oligomeric Details

dimeric

R-Factor

0.1661

Scattering Type

x-ray

Attribution

PubMed ID

Digital Object Identifier (DOI)

10.1021/acs.jmedchem.5b00900

Citation Title

Design of HIV-1 Protease Inhibitors with Amino-bis-tetrahydrofuran Derivatives as P2-Ligands to Enhance Backbone-Binding Interactions: Synthesis, Biological Evaluation, and Protein-Ligand X-ray Studies.

Citation Year

2015

STL/VRML Files

PDB-5BRY-ribbon-secondary.wrl

PDB-5BRY-ribbon-rainbow.wrl

PDB-5BRY-ribbon-bychain.wrl

PDB-5BRY-ribbon.stl

PDB-5BRY-ribbon-thick.stl

PDB-5BRY-surf-bychain.wrl

PDB-5BRY-surf-hydropathy.wrl

PDB-5BRY-surf-coulombic.wrl

PDB-5BRY-surf.stl

X3D Files

PDB-5BRY-ribbon-secondary.x3d

PDB-5BRY-ribbon-rainbow.x3d

PDB-5BRY-ribbon-bychain.x3d

PDB-5BRY-ribbon.x3d

PDB-5BRY-ribbon-thick.x3d

PDB-5BRY-surf-bychain.x3d

PDB-5BRY-surf-hydropathy.x3d

PDB-5BRY-surf-coulombic.x3d

PDB-5BRY-surf.x3d

Blender Files

PDB-5BRY-ribbon-secondary.blend

PDB-5BRY-ribbon-rainbow.blend

PDB-5BRY-ribbon-bychain.blend

PDB-5BRY-ribbon.blend

PDB-5BRY-ribbon-thick.blend

PDB-5BRY-surf-bychain.blend

PDB-5BRY-surf-hydropathy.blend

PDB-5BRY-surf-coulombic.blend

PDB-5BRY-surf.blend

PDB-5BRY-ribbon-secondary.x3d

PDB-5BRY-ribbon-rainbow.x3d

PDB-5BRY-ribbon-bychain.x3d

PDB-5BRY-ribbon.x3d

PDB-5BRY-ribbon-thick.x3d

PDB-5BRY-surf-bychain.x3d

PDB-5BRY-surf-hydropathy.x3d

PDB-5BRY-surf-coulombic.x3d

PDB-5BRY-surf.x3d

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