Chlorine in PDB 6ysn: Human TRPC5 in Complex with PICO145 (Hc-608)

The structure of Human TRPC5 in Complex with PICO145 (Hc-608) also contains other interesting chemical elements:

Fluorine

(F)

12 atoms

The binding sites of Chlorine atom in the Human TRPC5 in Complex with PICO145 (Hc-608) (pdb code 6ysn). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Human TRPC5 in Complex with PICO145 (Hc-608), PDB code: 6ysn:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in the Human TRPC5 in Complex with PICO145 (Hc-608)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Human TRPC5 in Complex with PICO145 (Hc-608) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl901 b:22.5 occ:1.00 CL1 A:PJQ901 0.0 22.5 1.0 C24 A:PJQ901 1.8 22.5 1.0 C23 A:PJQ901 2.8 22.5 1.0 C26 A:PJQ901 2.8 22.5 1.0 CE1 A:PHE569 3.9 27.3 1.0 CD1 A:PHE569 4.0 27.3 1.0 C22 A:PJQ901 4.1 22.5 1.0 C27 A:PJQ901 4.1 22.5 1.0 CD1 A:LEU572 4.2 20.2 1.0 C21 A:PJQ901 4.6 22.5 1.0

Chlorine binding site 2 out of 4 in the Human TRPC5 in Complex with PICO145 (Hc-608)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Human TRPC5 in Complex with PICO145 (Hc-608) within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl901 b:23.9 occ:1.00 CL1 B:PJQ901 0.0 23.9 1.0 C24 B:PJQ901 1.8 23.9 1.0 C23 B:PJQ901 2.8 23.9 1.0 C26 B:PJQ901 2.8 23.9 1.0 CE1 B:PHE569 3.9 26.8 1.0 CD1 B:PHE569 4.0 26.8 1.0 C22 B:PJQ901 4.1 23.9 1.0 C27 B:PJQ901 4.1 23.9 1.0 CD1 B:LEU572 4.2 19.0 1.0 C21 B:PJQ901 4.6 23.9 1.0

Chlorine binding site 3 out of 4 in the Human TRPC5 in Complex with PICO145 (Hc-608)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Human TRPC5 in Complex with PICO145 (Hc-608) within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl901 b:21.7 occ:1.00 CL1 C:PJQ901 0.0 21.7 1.0 C24 C:PJQ901 1.8 21.7 1.0 C23 C:PJQ901 2.8 21.7 1.0 C26 C:PJQ901 2.8 21.7 1.0 CE1 C:PHE569 3.9 26.5 1.0 CD1 C:PHE569 4.0 26.5 1.0 C22 C:PJQ901 4.1 21.7 1.0 C27 C:PJQ901 4.1 21.7 1.0 CD1 C:LEU572 4.2 19.2 1.0 C21 C:PJQ901 4.6 21.7 1.0

Chlorine binding site 4 out of 4 in the Human TRPC5 in Complex with PICO145 (Hc-608)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Human TRPC5 in Complex with PICO145 (Hc-608) within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl801 b:21.7 occ:1.00 CL1 D:PJQ801 0.0 21.7 1.0 C24 D:PJQ801 1.8 21.7 1.0 C23 D:PJQ801 2.8 21.7 1.0 C26 D:PJQ801 2.8 21.7 1.0 CE1 D:PHE569 3.9 25.9 1.0 CD1 D:PHE569 4.0 25.9 1.0 C22 D:PJQ801 4.1 21.7 1.0 C27 D:PJQ801 4.1 21.7 1.0 CD1 D:LEU572 4.2 18.7 1.0 C21 D:PJQ801 4.6 21.7 1.0

D.J.Wright, K.J.Simmons, R.M.Johnson, D.J.Beech, S.P.Muench, R.S.Bon. Human TRPC5 Structures Reveal Interaction of A Xanthine-Based TRPC1/4/5 Inhibitor with A Conserved Lipid Binding Site. Commun Biol V. 3 704 2020.
ISSN: ESSN 2399-3642
PubMed: 33230284
DOI: 10.1038/S42003-020-01437-8