CRYSTAL STRUCTURE OF PI3K DELTA IN COMPLEX WITH A 7-(3-(PIPERAZIN-1-YL)PHENYL)PYRROLO[2,1-F][1,2,4] TRIAZIN-4-AMINE DERIVIATINE

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Created on Fri, 2022-01-28 12:30, last updated on Fri, 2022-01-28 12:30

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General Information

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

Model ID

3DPX-016735

Category

Proteins, Macromolecules and Viruses

Keyword(s)

lipid kinase, INHIBITOR, PI3K DELTA, TRANSFERASE-TRANSFERASE INHIBITOR complex, TRANSFERASE-TRANSFERASE REGULATOR complex

Protein Data Bank ID

5UBT

Experimental Method

X-RAY DIFFRACTION

Resolution

2.830

Model Details

Associated Species

unidentified baculovirus

Oligomeric Details

dimeric

R-Factor

0.216

Scattering Type

x-ray

Attribution

PubMed ID

28 108 251

Digital Object Identifier (DOI)

10.1016/j.bmcl.2017.01.016

Citation Title

Discovery of 7-(3-(piperazin-1-yl)phenyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine derivatives as highly potent and selective PI3K delta inhibitors.

Citation Year

2017

STL/VRML Files

PDB-5UBT-ribbon-secondary.wrl

PDB-5UBT-ribbon-rainbow.wrl

PDB-5UBT-ribbon-bychain.wrl

PDB-5UBT-ribbon.stl

PDB-5UBT-surf-bychain.wrl

PDB-5UBT-surf-hydropathy.wrl

PDB-5UBT-surf-coulombic.wrl

PDB-5UBT-surf.stl

PDB-5UBT.zip

X3D Files

PDB-5UBT-ribbon-secondary.x3d

PDB-5UBT-ribbon-rainbow.x3d

PDB-5UBT-ribbon-bychain.x3d

PDB-5UBT-ribbon.x3d

PDB-5UBT-surf-bychain.x3d

PDB-5UBT-surf-hydropathy.x3d

PDB-5UBT-surf-coulombic.x3d

PDB-5UBT-surf.x3d

QR Code for https://3dprint.nih.gov/discover/3dpx-016735

CRYSTAL STRUCTURE OF PI3K DELTA IN COMPLEX WITH A 7-(3-(PIPERAZIN-1-YL)PHENYL)PYRROLO[2,1-F][1,2,4] TRIAZIN-4-AMINE DERIVIATINE

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