Fluorine in PDB 7e27: Structure of Pffnt in Complex with MMV007839

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>>> Page 1 <<< Page 2, Binding sites: 11 - 20; Page 3, Binding sites: 21 - 25;

Binding sites:

The binding sites of Fluorine atom in the Structure of Pffnt in Complex with MMV007839 (pdb code 7e27). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 25 binding sites of Fluorine where determined in the Structure of Pffnt in Complex with MMV007839, PDB code: 7e27:
Jump to Fluorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Fluorine binding site 1 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ A:F401 b:42.8 occ:1.00 F16 A:HV6401 0.0 42.8 1.0 C15 A:HV6401 1.4 42.8 1.0 F18 A:HV6401 2.2 42.8 1.0 F17 A:HV6401 2.2 42.8 1.0 C14 A:HV6401 2.4 42.8 1.0 F19 A:HV6401 2.8 42.8 1.0 C12 A:HV6401 2.9 42.8 1.0 CD2 A:LEU104 3.4 43.1 1.0 O21 A:HV6401 3.4 42.8 1.0 F20 A:HV6401 3.5 42.8 1.0 CG2 A:VAL54 3.6 40.4 1.0 NE2 A:HIS230 3.7 40.4 1.0 C11 A:HV6401 3.7 42.8 1.0 CE1 A:HIS230 3.8 40.4 1.0 CD1 A:ILE97 4.4 42.7 1.0 CD2 A:HIS230 4.5 40.4 1.0 CB A:ALA93 4.6 40.9 1.0 CE2 A:PHE90 4.6 38.6 1.0 CZ A:PHE90 4.6 38.6 1.0 CG1 A:VAL54 4.7 40.4 1.0 ND1 A:HIS230 4.7 40.4 1.0 CB A:VAL54 4.7 40.4 1.0 C09 A:HV6401 4.8 42.8 1.0 CG A:LEU104 4.8 43.1 1.0

Fluorine binding site 2 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ A:F401 b:42.8 occ:1.00 F17 A:HV6401 0.0 42.8 1.0 C15 A:HV6401 1.4 42.8 1.0 F18 A:HV6401 2.2 42.8 1.0 F16 A:HV6401 2.2 42.8 1.0 C14 A:HV6401 2.4 42.8 1.0 F20 A:HV6401 2.7 42.8 1.0 C12 A:HV6401 3.0 42.8 1.0 C11 A:HV6401 3.1 42.8 1.0 N A:PHE94 3.4 41.8 1.0 CB A:ALA93 3.5 40.9 1.0 F19 A:HV6401 3.5 42.8 1.0 C A:ALA93 3.5 40.9 1.0 CD1 A:ILE97 3.6 42.7 1.0 CA A:PHE94 3.7 41.8 1.0 O A:ALA93 3.9 40.9 1.0 CA A:ALA93 4.1 40.9 1.0 O21 A:HV6401 4.2 42.8 1.0 CB A:PHE94 4.2 41.8 1.0 C09 A:HV6401 4.4 42.8 1.0 CD2 A:PHE94 4.4 41.8 1.0 CD2 A:LEU104 4.5 43.1 1.0 CG2 A:VAL54 4.6 40.4 1.0 CG A:PHE94 4.7 41.8 1.0 C07 A:HV6401 4.9 42.8 1.0 CG1 A:ILE97 4.9 42.7 1.0 N A:ALA93 5.0 40.9 1.0

Fluorine binding site 3 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ A:F401 b:42.8 occ:1.00 F18 A:HV6401 0.0 42.8 1.0 C15 A:HV6401 1.4 42.8 1.0 F17 A:HV6401 2.2 42.8 1.0 F16 A:HV6401 2.2 42.8 1.0 C14 A:HV6401 2.3 42.8 1.0 F19 A:HV6401 2.6 42.8 1.0 F20 A:HV6401 2.7 42.8 1.0 CE2 A:PHE90 3.2 38.6 1.0 C12 A:HV6401 3.7 42.8 1.0 CZ A:PHE90 3.7 38.6 1.0 CB A:ALA93 3.9 40.9 1.0 CD2 A:PHE90 4.0 38.6 1.0 CG1 A:VAL220 4.1 38.6 1.0 C11 A:HV6401 4.4 42.8 1.0 O21 A:HV6401 4.6 42.8 1.0 CZ A:PHE223 4.6 39.4 1.0 CG2 A:VAL220 4.6 38.6 1.0 N A:PHE94 4.6 41.8 1.0 CE1 A:PHE90 4.8 38.6 1.0 C A:ALA93 4.9 40.9 1.0 NE2 A:HIS230 4.9 40.4 1.0 CA A:ALA93 4.9 40.9 1.0 CE2 A:PHE223 4.9 39.4 1.0

Fluorine binding site 4 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 4 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ A:F401 b:42.8 occ:1.00 F19 A:HV6401 0.0 42.8 1.0 C14 A:HV6401 1.4 42.8 1.0 F20 A:HV6401 2.2 42.8 1.0 C15 A:HV6401 2.3 42.8 1.0 C12 A:HV6401 2.3 42.8 1.0 F18 A:HV6401 2.6 42.8 1.0 O21 A:HV6401 2.7 42.8 1.0 F16 A:HV6401 2.8 42.8 1.0 NE2 A:HIS230 3.1 40.4 1.0 CD2 A:HIS230 3.3 40.4 1.0 CZ A:PHE223 3.5 39.4 1.0 F17 A:HV6401 3.5 42.8 1.0 C11 A:HV6401 3.6 42.8 1.0 CG2 A:VAL196 3.6 41.4 1.0 CE2 A:PHE223 3.7 39.4 1.0 CE1 A:HIS230 4.1 40.4 1.0 CG A:HIS230 4.4 40.4 1.0 CG1 A:VAL196 4.5 41.4 1.0 CG2 A:VAL220 4.5 38.6 1.0 CB A:VAL196 4.6 41.4 1.0 CE1 A:PHE223 4.7 39.4 1.0 ND1 A:HIS230 4.8 40.4 1.0 C09 A:HV6401 4.8 42.8 1.0 CG1 A:VAL220 4.8 38.6 1.0 OG1 A:THR106 4.9 43.5 1.0 CE2 A:PHE90 4.9 38.6 1.0 CD2 A:LEU104 5.0 43.1 1.0 CD2 A:PHE223 5.0 39.4 1.0

Fluorine binding site 5 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 5 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ A:F401 b:42.8 occ:1.00 F20 A:HV6401 0.0 42.8 1.0 C14 A:HV6401 1.4 42.8 1.0 F19 A:HV6401 2.2 42.8 1.0 C15 A:HV6401 2.3 42.8 1.0 C12 A:HV6401 2.4 42.8 1.0 F17 A:HV6401 2.7 42.8 1.0 F18 A:HV6401 2.7 42.8 1.0 C11 A:HV6401 2.8 42.8 1.0 CD2 A:PHE94 3.2 41.8 1.0 CG2 A:VAL220 3.4 38.6 1.0 O21 A:HV6401 3.5 42.8 1.0 F16 A:HV6401 3.5 42.8 1.0 CE2 A:PHE94 4.0 41.8 1.0 CG A:PHE94 4.1 41.8 1.0 CB A:PHE94 4.2 41.8 1.0 C09 A:HV6401 4.3 42.8 1.0 CG1 A:VAL220 4.4 38.6 1.0 CB A:VAL220 4.5 38.6 1.0 CE2 A:PHE223 4.6 39.4 1.0 CA A:PHE94 4.6 41.8 1.0 CG2 A:VAL196 4.7 41.4 1.0 N A:PHE94 4.8 41.8 1.0 CZ A:PHE223 4.9 39.4 1.0 O10 A:HV6401 4.9 42.8 1.0 CG1 A:VAL196 5.0 41.4 1.0

Fluorine binding site 6 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 6 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ B:F401 b:43.7 occ:1.00 F16 B:HV6401 0.0 43.7 1.0 C15 B:HV6401 1.4 43.7 1.0 F18 B:HV6401 2.2 43.7 1.0 F17 B:HV6401 2.2 43.7 1.0 C14 B:HV6401 2.4 43.7 1.0 F19 B:HV6401 2.8 43.7 1.0 C12 B:HV6401 2.9 43.7 1.0 CD2 B:LEU104 3.4 43.6 1.0 O21 B:HV6401 3.4 43.7 1.0 F20 B:HV6401 3.5 43.7 1.0 CG2 B:VAL54 3.6 41.1 1.0 NE2 B:HIS230 3.7 41.1 1.0 C11 B:HV6401 3.7 43.7 1.0 CE1 B:HIS230 3.8 41.1 1.0 CD1 B:ILE97 4.4 43.3 1.0 CD2 B:HIS230 4.5 41.1 1.0 CB B:ALA93 4.6 41.5 1.0 CE2 B:PHE90 4.6 39.0 1.0 CZ B:PHE90 4.6 39.0 1.0 CG1 B:VAL54 4.7 41.1 1.0 ND1 B:HIS230 4.7 41.1 1.0 CB B:VAL54 4.7 41.1 1.0 C09 B:HV6401 4.8 43.7 1.0 CG B:LEU104 4.8 43.6 1.0

Fluorine binding site 7 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 7 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ B:F401 b:43.7 occ:1.00 F17 B:HV6401 0.0 43.7 1.0 C15 B:HV6401 1.4 43.7 1.0 F18 B:HV6401 2.2 43.7 1.0 F16 B:HV6401 2.2 43.7 1.0 C14 B:HV6401 2.4 43.7 1.0 F20 B:HV6401 2.7 43.7 1.0 C12 B:HV6401 3.0 43.7 1.0 C11 B:HV6401 3.1 43.7 1.0 N B:PHE94 3.4 42.5 1.0 CB B:ALA93 3.5 41.5 1.0 F19 B:HV6401 3.5 43.7 1.0 C B:ALA93 3.5 41.5 1.0 CD1 B:ILE97 3.6 43.3 1.0 CA B:PHE94 3.7 42.5 1.0 O B:ALA93 3.9 41.5 1.0 CA B:ALA93 4.1 41.5 1.0 O21 B:HV6401 4.2 43.7 1.0 CB B:PHE94 4.2 42.5 1.0 C09 B:HV6401 4.4 43.7 1.0 CD2 B:PHE94 4.4 42.5 1.0 CD2 B:LEU104 4.5 43.6 1.0 CG2 B:VAL54 4.6 41.1 1.0 CG B:PHE94 4.7 42.5 1.0 C07 B:HV6401 4.9 43.7 1.0 CG1 B:ILE97 4.9 43.3 1.0 N B:ALA93 5.0 41.5 1.0

Fluorine binding site 8 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 8 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ B:F401 b:43.7 occ:1.00 F18 B:HV6401 0.0 43.7 1.0 C15 B:HV6401 1.4 43.7 1.0 F17 B:HV6401 2.2 43.7 1.0 F16 B:HV6401 2.2 43.7 1.0 C14 B:HV6401 2.3 43.7 1.0 F19 B:HV6401 2.6 43.7 1.0 F20 B:HV6401 2.7 43.7 1.0 CE2 B:PHE90 3.2 39.0 1.0 C12 B:HV6401 3.7 43.7 1.0 CZ B:PHE90 3.7 39.0 1.0 CB B:ALA93 3.9 41.5 1.0 CD2 B:PHE90 4.0 39.0 1.0 CG1 B:VAL220 4.1 39.3 1.0 C11 B:HV6401 4.4 43.7 1.0 O21 B:HV6401 4.6 43.7 1.0 CZ B:PHE223 4.6 39.9 1.0 CG2 B:VAL220 4.6 39.3 1.0 N B:PHE94 4.6 42.5 1.0 CE1 B:PHE90 4.8 39.0 1.0 C B:ALA93 4.9 41.5 1.0 NE2 B:HIS230 4.9 41.1 1.0 CA B:ALA93 4.9 41.5 1.0 CE2 B:PHE223 4.9 39.9 1.0

Fluorine binding site 9 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 9 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ B:F401 b:43.7 occ:1.00 F19 B:HV6401 0.0 43.7 1.0 C14 B:HV6401 1.4 43.7 1.0 F20 B:HV6401 2.2 43.7 1.0 C15 B:HV6401 2.3 43.7 1.0 C12 B:HV6401 2.3 43.7 1.0 F18 B:HV6401 2.6 43.7 1.0 O21 B:HV6401 2.7 43.7 1.0 F16 B:HV6401 2.8 43.7 1.0 NE2 B:HIS230 3.1 41.1 1.0 CD2 B:HIS230 3.3 41.1 1.0 CZ B:PHE223 3.5 39.9 1.0 F17 B:HV6401 3.5 43.7 1.0 C11 B:HV6401 3.6 43.7 1.0 CG2 B:VAL196 3.6 42.0 1.0 CE2 B:PHE223 3.7 39.9 1.0 CE1 B:HIS230 4.1 41.1 1.0 CG B:HIS230 4.4 41.1 1.0 CG1 B:VAL196 4.5 42.0 1.0 CG2 B:VAL220 4.5 39.3 1.0 CB B:VAL196 4.6 42.0 1.0 CE1 B:PHE223 4.7 39.9 1.0 ND1 B:HIS230 4.8 41.1 1.0 C09 B:HV6401 4.8 43.7 1.0 CG1 B:VAL220 4.8 39.3 1.0 OG1 B:THR106 4.8 43.8 1.0 CE2 B:PHE90 4.9 39.0 1.0 CD2 B:LEU104 5.0 43.6 1.0 CD2 B:PHE223 5.0 39.9 1.0

Fluorine binding site 10 out of 25 in the Structure of Pffnt in Complex with MMV007839


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 10 of Structure of Pffnt in Complex with MMV007839 within 5.0Å range: probe atom residue distance (Å) B Occ B:F401 b:43.7 occ:1.00 F20 B:HV6401 0.0 43.7 1.0 C14 B:HV6401 1.4 43.7 1.0 F19 B:HV6401 2.2 43.7 1.0 C15 B:HV6401 2.3 43.7 1.0 C12 B:HV6401 2.4 43.7 1.0 F17 B:HV6401 2.7 43.7 1.0 F18 B:HV6401 2.7 43.7 1.0 C11 B:HV6401 2.8 43.7 1.0 CD2 B:PHE94 3.2 42.5 1.0 CG2 B:VAL220 3.4 39.3 1.0 O21 B:HV6401 3.5 43.7 1.0 F16 B:HV6401 3.5 43.7 1.0 CE2 B:PHE94 4.0 42.5 1.0 CG B:PHE94 4.1 42.5 1.0 CB B:PHE94 4.2 42.5 1.0 C09 B:HV6401 4.3 43.7 1.0 CG1 B:VAL220 4.4 39.3 1.0 CB B:VAL220 4.5 39.3 1.0 CE2 B:PHE223 4.6 39.9 1.0 CA B:PHE94 4.6 42.5 1.0 CG2 B:VAL196 4.7 42.0 1.0 N B:PHE94 4.8 42.5 1.0 CZ B:PHE223 4.9 39.9 1.0 O10 B:HV6401 4.9 43.7 1.0 CG1 B:VAL196 5.0 42.0 1.0

C.Y.Yan, X.Jiang, D.Deng. Structure of Pffnt in Complex with MMV007839 To Be Published.