Chlorine in PDB 8wby: Cryo-Em Structure of ACE2-B0AT1 Complex with JX98

The binding sites of Chlorine atom in the Cryo-Em Structure of ACE2-B0AT1 Complex with JX98 (pdb code 8wby). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Cryo-Em Structure of ACE2-B0AT1 Complex with JX98, PDB code: 8wby:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Cryo-Em Structure of ACE2-B0AT1 Complex with JX98


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Cryo-Em Structure of ACE2-B0AT1 Complex with JX98 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl701 b:101.1 occ:1.00 CL1 A:WM8701 0.0 101.1 1.0 C12 A:WM8701 1.8 89.9 1.0 C14 A:WM8701 2.7 88.7 1.0 C10 A:WM8701 2.7 88.6 1.0 C15 A:WM8701 2.9 91.3 1.0 C11 A:WM8701 3.0 88.6 1.0 CE1 A:PHE420 3.7 81.4 1.0 C16 A:WM8701 4.0 90.4 1.0 C09 A:WM8701 4.0 89.5 1.0 CE A:MET423 4.2 89.2 1.0 SD A:MET423 4.2 93.9 1.0 CD2 A:LEU234 4.3 93.6 1.0 C08 A:WM8701 4.5 91.1 1.0 CD1 A:PHE420 4.5 80.0 1.0 CZ A:PHE420 4.6 81.1 1.0 CD2 A:LEU424 4.9 78.9 1.0

Chlorine binding site 2 out of 2 in the Cryo-Em Structure of ACE2-B0AT1 Complex with JX98


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Cryo-Em Structure of ACE2-B0AT1 Complex with JX98 within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl701 b:101.1 occ:1.00 CL1 D:WM8701 0.0 101.1 1.0 C12 D:WM8701 1.8 89.9 1.0 C14 D:WM8701 2.7 88.7 1.0 C10 D:WM8701 2.7 88.6 1.0 C15 D:WM8701 2.9 91.3 1.0 C11 D:WM8701 3.0 88.6 1.0 SD D:MET423 3.8 98.0 1.0 CE1 D:PHE420 3.8 86.5 1.0 C16 D:WM8701 4.0 90.4 1.0 C09 D:WM8701 4.0 89.5 1.0 CD2 D:LEU234 4.2 99.8 1.0 CE D:MET423 4.2 91.6 1.0 CD2 D:LEU424 4.5 82.4 1.0 C08 D:WM8701 4.5 91.1 1.0 CD1 D:PHE420 4.6 85.2 1.0 CZ D:PHE420 4.7 86.4 1.0 CG D:MET423 5.0 90.4 1.0

J.Xu, Z.Hu, L.Dai, A.Yadav, Y.Jiang, A.Broer, M.G.Gardiner, M.Mcleod, R.Yan, S.Broer. Molecular Basis of Inhibition of the Amino Acid Transporter B 0 AT1 (SLC6A19). Nat Commun V. 15 7224 2024.
ISSN: ESSN 2041-1723
PubMed: 39174516
DOI: 10.1038/S41467-024-51748-1