Fluorine in PDB 6lyy: Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation.

The binding sites of Fluorine atom in the Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation. (pdb code 6lyy). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 3 binding sites of Fluorine where determined in the Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation., PDB code: 6lyy:
Jump to Fluorine binding site number: 1; 2; 3;

Fluorine binding site 1 out of 3 in the Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation.


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation. within 5.0Å range: probe atom residue distance (Å) B Occ A:F601 b:91.0 occ:1.00 F23 A:EY0601 0.0 91.0 1.0 C22 A:EY0601 1.4 91.0 1.0 F24 A:EY0601 2.2 91.0 1.0 F25 A:EY0601 2.2 91.0 1.0 C21 A:EY0601 2.4 91.0 1.0 N20 A:EY0601 2.8 91.0 1.0 CD A:LYS38 3.3 90.5 1.0 CG A:LYS38 3.4 90.5 1.0 CB A:LYS38 3.4 90.5 1.0 C17 A:EY0601 3.7 91.0 1.0 CE A:LYS38 4.1 90.5 1.0 N19 A:EY0601 4.1 91.0 1.0 CD2 A:LEU281 4.2 91.4 1.0 C16 A:EY0601 4.5 91.0 1.0 CA A:LYS38 4.5 90.5 1.0 C18 A:EY0601 4.5 91.0 1.0 CG2 A:VAL282 4.7 91.2 1.0 O A:LEU281 4.9 91.4 1.0 CB A:VAL282 5.0 91.2 1.0

Fluorine binding site 2 out of 3 in the Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation.


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation. within 5.0Å range: probe atom residue distance (Å) B Occ A:F601 b:91.0 occ:1.00 F24 A:EY0601 0.0 91.0 1.0 C22 A:EY0601 1.4 91.0 1.0 F25 A:EY0601 2.2 91.0 1.0 F23 A:EY0601 2.2 91.0 1.0 CD2 A:LEU281 2.3 91.4 1.0 C21 A:EY0601 2.4 91.0 1.0 N20 A:EY0601 3.2 91.0 1.0 C17 A:EY0601 3.3 91.0 1.0 CG A:LEU281 3.7 91.4 1.0 C16 A:EY0601 3.8 91.0 1.0 O A:LEU281 4.0 91.4 1.0 N19 A:EY0601 4.3 91.0 1.0 CB A:LEU281 4.3 91.4 1.0 C A:LEU281 4.3 91.4 1.0 C18 A:EY0601 4.4 91.0 1.0 CD1 A:LEU281 4.5 91.4 1.0 CZ A:PHE278 4.6 92.7 1.0 C8 A:EY0601 4.6 91.0 1.0 CB A:VAL282 4.6 91.2 1.0 N A:VAL282 4.7 91.2 1.0 CA A:VAL282 4.8 91.2 1.0 S7 A:EY0601 4.8 91.0 1.0 CE1 A:PHE278 4.8 92.7 1.0 CE2 A:PHE278 5.0 92.7 1.0 CG2 A:VAL282 5.0 91.2 1.0

Fluorine binding site 3 out of 3 in the Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation.


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Cryo-Em Structure of the Human MCT1/Basigin-2 Complex in the Presence of Anti-Cancer Drug Candidate AZD3965 in the Outward-Open Conformation. within 5.0Å range: probe atom residue distance (Å) B Occ A:F601 b:91.0 occ:1.00 F25 A:EY0601 0.0 91.0 1.0 C22 A:EY0601 1.4 91.0 1.0 F24 A:EY0601 2.2 91.0 1.0 F23 A:EY0601 2.2 91.0 1.0 C21 A:EY0601 2.4 91.0 1.0 C17 A:EY0601 2.9 91.0 1.0 C16 A:EY0601 2.9 91.0 1.0 CD2 A:LEU281 3.4 91.4 1.0 N20 A:EY0601 3.6 91.0 1.0 CG A:LYS38 3.8 90.5 1.0 CB A:LYS38 3.9 90.5 1.0 C18 A:EY0601 4.2 91.0 1.0 C8 A:EY0601 4.3 91.0 1.0 CD1 A:LEU158 4.3 89.0 1.0 CD2 A:LEU158 4.4 89.0 1.0 N19 A:EY0601 4.5 91.0 1.0 CD A:LYS38 4.5 90.5 1.0 C32 A:EY0601 4.6 91.0 1.0 C35 A:EY0601 4.7 91.0 1.0 CG A:LEU281 4.8 91.4 1.0

N.Wang, X.Jiang, S.Zhang, A.Zhu, Y.Yuan, J.Lei, C.Yan. Structural Basis of Human Monocarboxylate Transporter 1 Inhibition By Anti-Cancer Drug Candidates To Be Published.