Fluorine in PDB 7svr: The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809)

All present enzymatic activity of The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809):
5.6.1.6;

The binding sites of Fluorine atom in the The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809) (pdb code 7svr). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 2 binding sites of Fluorine where determined in the The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809), PDB code: 7svr:
Jump to Fluorine binding site number: 1; 2;

Fluorine binding site 1 out of 2 in the The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809)


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809) within 5.0Å range: probe atom residue distance (Å) B Occ A:F1501 b:89.0 occ:1.00 F1 A:VX81501 0.0 89.0 1.0 C20 A:VX81501 1.4 89.0 1.0 F2 A:VX81501 2.2 89.0 1.0 O4 A:VX81501 2.3 89.0 1.0 O5 A:VX81501 2.3 89.0 1.0 OG A:SER364 3.2 80.1 1.0 CB A:SER364 3.2 80.1 1.0 C16 A:VX81501 3.3 89.0 1.0 C17 A:VX81501 3.3 89.0 1.0 CG2 A:THR360 3.6 78.5 1.0 O A:THR360 3.8 78.5 1.0 CD1 A:TRP361 3.9 78.8 1.0 CA A:TRP361 4.0 78.8 1.0 CG A:TRP361 4.0 78.8 1.0 NE1 A:TRP361 4.0 78.8 1.0 O A:GLY194 4.1 81.7 1.0 C A:THR360 4.1 78.5 1.0 CD2 A:TRP361 4.1 78.8 1.0 CE2 A:TRP361 4.1 78.8 1.0 N A:TRP361 4.2 78.8 1.0 CB A:TRP361 4.6 78.8 1.0 CB A:ALA198 4.7 79.0 1.0 C15 A:VX81501 4.7 89.0 1.0 C18 A:VX81501 4.7 89.0 1.0 CA A:SER364 4.7 80.1 1.0 CB A:THR360 4.8 78.5 1.0 CE3 A:TRP361 4.8 78.8 1.0 CD2 A:LEU195 4.8 77.9 1.0 CZ2 A:TRP361 4.8 78.8 1.0 C A:TRP361 5.0 78.8 1.0

Fluorine binding site 2 out of 2 in the The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809)


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of The Complex of Dephosphorylated Human Cystic Fibrosis Transmembrane Conductance Regulator (Cftr) and Lumacaftor (Vx-809) within 5.0Å range: probe atom residue distance (Å) B Occ A:F1501 b:89.0 occ:1.00 F2 A:VX81501 0.0 89.0 1.0 C20 A:VX81501 1.4 89.0 1.0 F1 A:VX81501 2.2 89.0 1.0 O4 A:VX81501 2.3 89.0 1.0 O5 A:VX81501 2.3 89.0 1.0 O A:GLY194 2.4 81.7 1.0 C16 A:VX81501 3.1 89.0 1.0 C17 A:VX81501 3.1 89.0 1.0 CD2 A:LEU195 3.1 77.9 1.0 OG A:SER364 3.3 80.1 1.0 C A:GLY194 3.6 81.7 1.0 CG A:LEU195 3.8 77.9 1.0 CB A:SER364 3.8 80.1 1.0 CG2 A:THR360 4.2 78.5 1.0 C15 A:VX81501 4.3 89.0 1.0 C18 A:VX81501 4.3 89.0 1.0 N A:LEU195 4.5 77.9 1.0 CA A:LEU195 4.6 77.9 1.0 CA A:GLY194 4.6 81.7 1.0 CB A:ALA198 4.7 79.0 1.0 CB A:LEU195 4.8 77.9 1.0 CD1 A:LEU195 4.9 77.9 1.0 CE1 A:PHE191 4.9 88.3 1.0

K.Fiedorczuk, J.Chen. Mechanism of Cftr Correction By Type I Folding Correctors. Cell V. 185 158 2022.
ISSN: ISSN 1097-4172
PubMed: 34995514
DOI: 10.1016/J.CELL.2021.12.009