Fluorine in PDB 4ga8: Human AKR1B10 Mutant V301L Complexed with Nadp+ and Sorbinil

The structure of Human AKR1B10 Mutant V301L Complexed with Nadp+ and Sorbinil, PDB code: 4ga8 was solved by A.Cousido-Siah, F.X.Ruiz Figueras, A.Mitschler, A.Podjarny, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	24.48 / 1.94
Space group	P 61
Cell size a, b, c (Å), α, β, γ (°)	89.300, 89.300, 78.155, 90.00, 90.00, 120.00
R / Rfree (%)	15.1 / 20.6

The binding sites of Fluorine atom in the Human AKR1B10 Mutant V301L Complexed with Nadp+ and Sorbinil (pdb code 4ga8). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total only one binding site of Fluorine was determined in the Human AKR1B10 Mutant V301L Complexed with Nadp+ and Sorbinil, PDB code: 4ga8:

Fluorine binding site 1 out of 1 in the Human AKR1B10 Mutant V301L Complexed with Nadp+ and Sorbinil


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Human AKR1B10 Mutant V301L Complexed with Nadp+ and Sorbinil within 5.0Å range: probe atom residue distance (Å) B Occ A:F402 b:32.6 occ:1.00 F1 A:SBI402 0.0 32.6 1.0 C1 A:SBI402 1.4 28.5 1.0 C2 A:SBI402 2.4 25.7 1.0 C11 A:SBI402 2.4 20.4 1.0 O A:HOH582 3.0 35.4 1.0 O A:VAL48 3.5 20.2 1.0 C3 A:SBI402 3.6 35.9 1.0 C10 A:SBI402 3.7 20.3 1.0 NE1 A:TRP21 3.7 19.4 1.0 CG1 A:VAL48 3.8 18.3 1.0 CG2 A:VAL48 3.9 18.8 1.0 CD1 A:TRP21 4.1 19.9 1.0 C4 A:SBI402 4.1 29.5 1.0 C A:VAL48 4.2 22.1 1.0 CD1 A:TYR49 4.4 15.4 1.0 CB A:VAL48 4.4 19.9 1.0 CZ A:PHE123 4.6 28.6 1.0 CE2 A:TRP21 4.7 20.5 1.0 N A:TYR49 4.7 18.4 1.0 CA A:TYR49 4.7 17.3 1.0 O A:HOH647 4.8 31.3 1.0 CE1 A:TYR49 4.8 19.1 1.0 CE2 A:PHE123 4.9 19.9 1.0 C7 A:SBI402 4.9 17.6 1.0 CA A:VAL48 4.9 16.8 1.0

A.Cousido-Siah, F.X.Ruiz Figueras, A.Mitschler, A.Podjarny. N/A N/A.