Chlorine in PDB 8cc7: Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939

The binding sites of Chlorine atom in the Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939 (pdb code 8cc7). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 5 binding sites of Chlorine where determined in the Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939, PDB code: 8cc7:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5;

Chlorine binding site 1 out of 5 in the Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl502 b:131.7 occ:1.00 CL01 A:U9Q502 0.0 131.7 1.0 C02 A:U9Q502 1.7 118.4 1.0 OG A:SER179 2.5 115.8 1.0 C03 A:U9Q502 2.7 116.7 1.0 C07 A:U9Q502 2.7 116.6 1.0 CG2 A:ILE180 3.5 101.8 1.0 CB A:SER179 3.7 115.8 1.0 CD1 A:ILE44 3.8 86.1 1.0 OD1 A:ASP177 3.8 118.1 1.0 CD1 B:ILE201 3.9 140.4 1.0 C04 A:U9Q502 3.9 118.0 1.0 C06 A:U9Q502 4.0 119.6 1.0 CG1 A:ILE180 4.2 97.1 1.0 C05 A:U9Q502 4.4 114.2 1.0 N A:ILE180 4.5 104.1 1.0 CB A:ILE180 4.5 97.9 1.0 OD2 A:ASP177 4.6 123.2 1.0 CG A:ASP177 4.7 120.0 1.0 CA A:SER179 4.9 119.7 1.0 CG2 A:ILE44 5.0 78.0 1.0

Chlorine binding site 2 out of 5 in the Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl502 b:128.9 occ:1.00 CL01 B:U9Q502 0.0 128.9 1.0 C02 B:U9Q502 1.7 115.0 1.0 OG B:SER179 2.5 126.5 1.0 C03 B:U9Q502 2.7 114.2 1.0 C07 B:U9Q502 2.7 114.4 1.0 CG2 B:ILE180 3.4 108.0 1.0 CD1 B:ILE44 3.8 91.8 1.0 OD1 B:ASP177 3.8 125.1 1.0 CB B:SER179 3.8 125.3 1.0 CD1 C:ILE201 3.9 139.7 1.0 C04 B:U9Q502 3.9 117.1 1.0 C06 B:U9Q502 4.0 117.0 1.0 CG1 B:ILE180 4.3 105.7 1.0 C05 B:U9Q502 4.4 112.7 1.0 CB B:ILE180 4.5 107.9 1.0 N B:ILE180 4.5 111.4 1.0 OD2 B:ASP177 4.5 125.1 1.0 CG B:ASP177 4.6 123.7 1.0 CA B:SER179 4.9 128.9 1.0 CG2 B:ILE44 5.0 80.3 1.0

Chlorine binding site 3 out of 5 in the Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939 within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl502 b:132.0 occ:1.00 CL01 C:U9Q502 0.0 132.0 1.0 C02 C:U9Q502 1.7 117.8 1.0 OG C:SER179 2.5 121.5 1.0 C03 C:U9Q502 2.7 117.4 1.0 C07 C:U9Q502 2.7 115.8 1.0 CG2 C:ILE180 3.4 103.2 1.0 CD1 C:ILE44 3.8 90.3 1.0 OD1 C:ASP177 3.8 122.4 1.0 CB C:SER179 3.8 121.6 1.0 CD1 D:ILE201 3.8 134.4 1.0 C04 C:U9Q502 3.9 118.7 1.0 C06 C:U9Q502 4.0 118.4 1.0 CG1 C:ILE180 4.3 100.3 1.0 C05 C:U9Q502 4.4 113.7 1.0 CB C:ILE180 4.5 101.2 1.0 N C:ILE180 4.5 105.2 1.0 OD2 C:ASP177 4.6 124.4 1.0 CG C:ASP177 4.6 122.7 1.0 CA C:SER179 4.9 124.8 1.0 CG1 C:ILE44 5.0 91.6 1.0

Chlorine binding site 4 out of 5 in the Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939 within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl502 b:135.1 occ:1.00 CL01 D:U9Q502 0.0 135.1 1.0 C02 D:U9Q502 1.7 115.8 1.0 OG D:SER179 2.5 124.6 1.0 C03 D:U9Q502 2.6 116.0 1.0 C07 D:U9Q502 2.7 113.4 1.0 CG2 D:ILE180 3.6 102.5 1.0 CB D:SER179 3.7 122.2 1.0 CD1 D:ILE44 3.8 90.3 1.0 OD1 D:ASP177 3.9 121.9 1.0 CD1 E:ILE201 3.9 135.0 1.0 C04 D:U9Q502 3.9 117.2 1.0 C06 D:U9Q502 4.0 118.2 1.0 CG1 D:ILE180 4.1 99.7 1.0 N D:ILE180 4.4 103.3 1.0 CB D:ILE180 4.4 101.4 1.0 C05 D:U9Q502 4.4 113.8 1.0 OD2 D:ASP177 4.7 127.2 1.0 CG D:ASP177 4.7 123.8 1.0 CA D:SER179 4.8 126.3 1.0 CG2 D:ILE44 5.0 83.2 1.0

Chlorine binding site 5 out of 5 in the Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of Mouse Serotonin 5-HT3A Receptor in Complex with Pz-1939 within 5.0Å range: probe atom residue distance (Å) B Occ E:Cl501 b:134.3 occ:1.00 CL01 E:U9Q501 0.0 134.3 1.0 C02 E:U9Q501 1.7 116.7 1.0 OG E:SER179 2.4 123.9 1.0 C03 E:U9Q501 2.7 115.8 1.0 C07 E:U9Q501 2.7 114.9 1.0 CB E:SER179 3.6 120.4 1.0 CD1 E:ILE44 3.8 88.7 1.0 CD1 A:ILE201 3.9 137.3 1.0 OD1 E:ASP177 3.9 112.7 1.0 C04 E:U9Q501 3.9 116.8 1.0 C06 E:U9Q501 4.0 118.3 1.0 CG2 E:ILE180 4.0 103.4 1.0 CG1 E:ILE180 4.3 100.0 1.0 C05 E:U9Q501 4.4 112.7 1.0 N E:ILE180 4.5 105.8 1.0 OD2 E:ASP177 4.7 118.7 1.0 CB E:ILE180 4.7 101.8 1.0 CG E:ASP177 4.7 113.9 1.0 CA E:SER179 4.8 124.3 1.0 CG2 E:ILE44 4.9 79.8 1.0

U.Lopez-Sanchez, H.Nury. Triple-Acting Mao-B Inhibitor and 5-HT6R/5-HT3R Antagonist J.Med.Chem. 2023.
ISSN: ISSN 0022-2623
DOI: 10.1021/ACS.JMEDCHEM.3C01482