Fluorine in PDB 6ow2: X-Ray Structure of Polypeptide Deformylase

Enzymatic activity of X-Ray Structure of Polypeptide Deformylase

All present enzymatic activity of X-Ray Structure of Polypeptide Deformylase:
3.5.1.88;

Protein crystallography data

The structure of X-Ray Structure of Polypeptide Deformylase, PDB code: 6ow2 was solved by N.Campobasso, J.Spletstoser, P.Ward, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 33.85 / 1.70
Space group P 43
Cell size a, b, c (Å), α, β, γ (°) 50.334, 50.334, 91.482, 90.00, 90.00, 90.00
R / Rfree (%) 19.8 / 22.3

Other elements in 6ow2:

The structure of X-Ray Structure of Polypeptide Deformylase also contains other interesting chemical elements:

Nickel (Ni) 1 atom

Fluorine Binding Sites:

The binding sites of Fluorine atom in the X-Ray Structure of Polypeptide Deformylase (pdb code 6ow2). 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 X-Ray Structure of Polypeptide Deformylase, PDB code: 6ow2:

Fluorine binding site 1 out of 1 in 6ow2

Go back to Fluorine Binding Sites List in 6ow2
Fluorine binding site 1 out of 1 in the X-Ray Structure of Polypeptide Deformylase


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of X-Ray Structure of Polypeptide Deformylase within 5.0Å range:
probe atom residue distance (Å) B Occ
P:F302

b:28.9
occ:1.00
F23 P:NB4302 0.0 28.9 1.0
C22 P:NB4302 1.3 24.0 1.0
H68 P:NB4302 2.1 32.7 1.0
C04 P:NB4302 2.3 22.2 1.0
C24 P:NB4302 2.4 23.3 1.0
H40 P:NB4302 2.5 27.1 1.0
N05 P:NB4302 2.7 22.6 1.0
C36 P:NB4302 2.8 27.3 1.0
N26 P:NB4302 2.9 22.4 1.0
O P:GLY69 2.9 23.4 1.0
C P:GLY69 3.0 22.1 1.0
N P:GLY70 3.3 23.8 1.0
H67 P:NB4302 3.5 32.7 1.0
H35 P:NB4302 3.6 35.0 1.0
N03 P:NB4302 3.6 21.5 1.0
N25 P:NB4302 3.6 24.6 1.0
CA P:GLY69 3.6 21.2 1.0
CA P:GLY70 3.7 20.7 1.0
C34 P:NB4302 3.8 29.2 1.0
O08 P:NB4302 4.0 21.1 1.0
N06 P:NB4302 4.0 23.5 1.0
C02 P:NB4302 4.0 21.0 1.0
C P:GLY70 4.0 20.5 1.0
H66 P:NB4302 4.1 34.9 1.0
N P:VAL71 4.2 18.5 1.0
C27 P:NB4302 4.3 25.6 1.0
C07 P:NB4302 4.4 19.2 1.0
C33 P:NB4302 4.5 29.1 1.0
CG1 P:VAL71 4.6 21.0 1.0
N P:GLY69 4.6 25.5 1.0
O P:GLY70 4.6 20.8 1.0
H41 P:NB4302 4.6 28.2 1.0
H58 P:NB4302 4.7 30.7 1.0
H57 P:NB4302 4.8 30.7 1.0
H60 P:NB4302 4.8 33.0 1.0
H65 P:NB4302 5.0 34.9 1.0
N29 P:NB4302 5.0 29.0 1.0
C28 P:NB4302 5.0 27.5 1.0

Reference:

J.T.Spletstoser, J.Dreabit, A.N.Knox, A.Benowitz, N.Campobasso, P.Ward, G.Cui, T.Lewandowski, L.Mccloskey, K.M.Aubart. Discovery of Piperazic Acid Peptide Deformylase Inhibitors with in Vivo Activity For Respiratory Tract and Skin Infections. Bioorg.Med.Chem.Lett. V. 29 2410 2019.
ISSN: ESSN 1464-3405
PubMed: 31160176
DOI: 10.1016/J.BMCL.2019.05.028
Page generated: Sun Dec 13 13:04:42 2020

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