Fluorine in PDB 8wpu: Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein

The structure of Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein also contains other interesting chemical elements:

Calcium

(Ca)

4 atoms

The binding sites of Fluorine atom in the Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein (pdb code 8wpu). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 6 binding sites of Fluorine where determined in the Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein, PDB code: 8wpu:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6;

Fluorine binding site 1 out of 6 in the Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein within 5.0Å range: probe atom residue distance (Å) B Occ B:F1105 b:87.1 occ:1.00 F1 B:YP41105 0.0 87.1 1.0 C12 B:YP41105 1.3 85.4 1.0 F2 B:YP41105 2.1 86.6 1.0 F3 B:YP41105 2.1 84.9 1.0 C8 B:YP41105 2.4 81.1 1.0 C7 B:YP41105 2.9 78.6 1.0 C9 B:YP41105 3.6 80.2 1.0 C6 B:YP41105 4.2 79.0 1.0 CD1 B:ILE777 4.6 86.1 1.0 C10 B:YP41105 4.7 80.3 1.0 C11 B:YP41105 5.0 79.9 1.0

Fluorine binding site 2 out of 6 in the Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein within 5.0Å range: probe atom residue distance (Å) B Occ B:F1105 b:86.6 occ:1.00 F2 B:YP41105 0.0 86.6 1.0 C12 B:YP41105 1.3 85.4 1.0 F1 B:YP41105 2.1 87.1 1.0 F3 B:YP41105 2.1 84.9 1.0 C8 B:YP41105 2.4 81.1 1.0 C7 B:YP41105 3.2 78.6 1.0 C9 B:YP41105 3.3 80.2 1.0 CD1 B:LEU770 3.8 104.1 1.0 C6 B:YP41105 4.4 79.0 1.0 CD1 B:ILE777 4.5 86.1 1.0 N B:GLY774 4.5 96.2 1.0 O B:LEU770 4.5 104.8 1.0 C10 B:YP41105 4.5 80.3 1.0 CA B:GLY774 4.6 93.1 1.0 CG B:LEU773 4.7 92.8 1.0 CB B:LEU773 4.7 96.3 1.0 C B:LEU773 4.9 95.1 1.0 C11 B:YP41105 5.0 79.9 1.0

Fluorine binding site 3 out of 6 in the Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein within 5.0Å range: probe atom residue distance (Å) B Occ B:F1105 b:84.9 occ:1.00 F3 B:YP41105 0.0 84.9 1.0 C12 B:YP41105 1.3 85.4 1.0 F1 B:YP41105 2.1 87.1 1.0 F2 B:YP41105 2.1 86.6 1.0 C8 B:YP41105 2.4 81.1 1.0 C9 B:YP41105 2.8 80.2 1.0 C7 B:YP41105 3.6 78.6 1.0 CD1 B:LEU770 4.0 104.1 1.0 C10 B:YP41105 4.1 80.3 1.0 C6 B:YP41105 4.8 79.0 1.0 CG B:LEU770 4.9 104.7 1.0 C11 B:YP41105 5.0 79.9 1.0

Fluorine binding site 4 out of 6 in the Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 4 of Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:F1110 b:66.0 occ:1.00 F1 A:YP41110 0.0 66.0 1.0 C12 A:YP41110 1.3 62.6 1.0 F2 A:YP41110 2.1 64.1 1.0 F3 A:YP41110 2.1 62.1 1.0 C8 A:YP41110 2.4 53.3 1.0 C9 A:YP41110 2.8 51.7 1.0 CB A:TRP818 3.3 33.3 1.0 O A:TRP818 3.4 48.5 1.0 C A:TRP818 3.5 38.6 1.0 C7 A:YP41110 3.7 56.0 1.0 N A:ILE819 4.0 35.2 1.0 CA A:TRP818 4.0 31.6 1.0 C10 A:YP41110 4.2 52.1 1.0 CG A:TRP818 4.3 38.4 1.0 CA A:ILE819 4.3 29.6 1.0 CG1 A:ILE822 4.5 36.8 1.0 CG1 A:ILE819 4.5 41.8 1.0 CD1 A:ILE822 4.6 42.2 1.0 CE3 A:TRP818 4.7 46.0 1.0 CD2 A:TRP818 4.7 44.9 1.0 C6 A:YP41110 4.8 56.9 1.0 CE2 A:YP41110 5.0 54.1 1.0

Fluorine binding site 5 out of 6 in the Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 5 of Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:F1110 b:64.1 occ:1.00 F2 A:YP41110 0.0 64.1 1.0 C12 A:YP41110 1.3 62.6 1.0 F1 A:YP41110 2.1 66.0 1.0 F3 A:YP41110 2.1 62.1 1.0 C8 A:YP41110 2.4 53.3 1.0 C7 A:YP41110 2.8 56.0 1.0 CE2 A:YP41110 3.3 54.1 1.0 CG2 A:ILE777 3.5 55.7 1.0 C9 A:YP41110 3.6 51.7 1.0 CZ A:YP41110 3.9 55.3 1.0 CD2 A:YP41110 4.1 56.5 1.0 CB A:TRP818 4.1 33.3 1.0 C6 A:YP41110 4.2 56.9 1.0 SG A:CYS781 4.5 69.3 1.0 CG A:TRP818 4.5 38.4 1.0 CE3 A:TRP818 4.7 46.0 1.0 CD1 A:ILE777 4.7 60.1 1.0 CD2 A:TRP818 4.7 44.9 1.0 C10 A:YP41110 4.7 52.1 1.0 CG1 A:ILE777 4.7 58.4 1.0 CB A:ILE777 4.7 53.9 1.0 C11 A:YP41110 5.0 53.2 1.0 CE1 A:YP41110 5.0 56.8 1.0

Fluorine binding site 6 out of 6 in the Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 6 of Human Calcium-Sensing Receptor(Casr) Bound to Cinacalcet in Complex with Gq Protein within 5.0Å range: probe atom residue distance (Å) B Occ A:F1110 b:62.1 occ:1.00 F3 A:YP41110 0.0 62.1 1.0 C12 A:YP41110 1.3 62.6 1.0 F1 A:YP41110 2.1 66.0 1.0 F2 A:YP41110 2.1 64.1 1.0 C8 A:YP41110 2.4 53.3 1.0 C7 A:YP41110 3.1 56.0 1.0 C9 A:YP41110 3.3 51.7 1.0 CG2 A:ILE777 4.0 55.7 1.0 C6 A:YP41110 4.4 56.9 1.0 CD1 A:ILE822 4.5 42.2 1.0 C10 A:YP41110 4.5 52.1 1.0 CG1 A:ILE822 4.7 36.8 1.0 C11 A:YP41110 4.9 53.2 1.0 CD1 A:ILE777 5.0 60.1 1.0

S.Ling, X.Meng, Y.Zhang, Z.Xia, Y.Zhou, F.Yang, P.Shi, C.Shi, C.Tian. Structural Insights Into Asymmetric Activation of the Calcium-Sensing Receptor-G Q Complex. Cell Res. 2023.
ISSN: ISSN 1001-0602
PubMed: 37919470
DOI: 10.1038/S41422-023-00892-2