Fluorine in PDB 7fal: Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro

The structure of Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro, PDB code: 7fal was solved by N.Malhotra, S.Mishra, M.Yogavel, A.Sharma, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	54.74 / 3.22
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	76.011, 86.333, 104.462, 90, 102.33, 90
R / Rfree (%)	22.9 / 25.3

The binding sites of Fluorine atom in the Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro (pdb code 7fal). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 2 binding sites of Fluorine where determined in the Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro, PDB code: 7fal:
Jump to Fluorine binding site number: 1; 2;

Fluorine binding site 1 out of 2 in the Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro within 5.0Å range: probe atom residue distance (Å) B Occ A:F901 b:54.7 occ:0.97 F A:1T0901 0.0 54.7 1.0 C10 A:1T0901 1.4 52.2 1.0 C9 A:1T0901 2.3 51.6 1.0 C11 A:1T0901 2.3 52.2 1.0 CB A:PRO476 3.1 60.9 1.0 CA A:PRO476 3.2 56.9 1.0 O A:LYS474 3.3 68.8 1.0 N A:PRO476 3.4 60.6 1.0 NE A:ARG483 3.6 61.3 1.0 C8 A:1T0901 3.6 53.7 1.0 C12 A:1T0901 3.6 52.7 1.0 CD A:PRO476 3.8 64.7 1.0 C A:GLN475 3.8 68.7 1.0 CG A:ARG483 3.8 56.8 1.0 CG A:PRO476 3.9 64.8 1.0 O A:GLU472 4.0 64.9 1.0 O A:GLN475 4.1 70.4 1.0 C13 A:1T0901 4.1 54.0 1.0 O A:ARG481 4.1 49.7 1.0 C A:LYS474 4.1 72.0 1.0 CD A:ARG483 4.3 59.0 1.0 NH2 A:ARG483 4.4 67.7 1.0 CZ A:ARG483 4.4 65.9 1.0 N A:LYS474 4.6 63.4 1.0 C A:PRO476 4.6 50.9 1.0 CA A:GLY363 4.7 57.5 1.0 N A:GLN475 4.7 69.3 1.0 CA A:GLN475 4.8 72.5 1.0 C A:GLU472 4.8 65.9 1.0 C14 A:1T0901 4.8 52.5 1.0 C7 A:1T0901 4.9 54.4 1.0 C A:ARG481 4.9 47.2 1.0 N A:ARG483 4.9 50.7 1.0 CA A:LYS474 4.9 67.6 1.0

Fluorine binding site 2 out of 2 in the Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro within 5.0Å range: probe atom residue distance (Å) B Occ B:F901 b:67.0 occ:0.94 F B:1T0901 0.0 67.0 0.9 C10 B:1T0901 1.4 63.5 0.9 C11 B:1T0901 2.3 62.3 0.9 C9 B:1T0901 2.3 61.7 0.9 CB B:PRO476 3.1 63.4 1.0 CA B:PRO476 3.2 61.9 1.0 O B:LYS474 3.3 72.6 1.0 N B:PRO476 3.5 65.5 1.0 C12 B:1T0901 3.6 60.1 0.9 C8 B:1T0901 3.6 60.2 0.9 CG B:ARG483 3.8 60.6 1.0 NE B:ARG483 3.9 69.7 1.0 O B:ARG481 3.9 52.6 1.0 CG B:PRO476 4.0 66.5 1.0 C B:GLN475 4.0 67.6 1.0 CD B:PRO476 4.0 67.4 1.0 C13 B:1T0901 4.1 60.6 0.9 O B:GLN475 4.2 66.5 1.0 O B:GLU472 4.2 77.8 1.0 CD B:ARG483 4.4 65.6 1.0 C B:LYS474 4.4 72.3 1.0 CA B:GLY363 4.5 56.8 1.0 C B:PRO476 4.7 58.7 1.0 C B:ARG481 4.7 51.7 1.0 CZ B:ARG483 4.8 73.4 1.0 N B:ARG483 4.8 52.5 1.0 NH2 B:ARG483 4.8 74.7 1.0 C14 B:1T0901 4.8 65.3 0.9 C7 B:1T0901 4.9 59.1 0.9 CA B:GLN475 4.9 72.5 1.0

N.Malhotra, S.Mishra, M.Yogavel, A.Sharma. Co-Crystal Structure of Toxoplasma Gondii Prolyl Trna Synthetase (Tgprs) in Complex with T36 and L-Pro To Be Published.