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Fluorine in PDB 5qou: Pandda Analysis Group Deposition -- Crystal Structure of DCP2 (NUDT20) in Complex with Z296300542

Enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of DCP2 (NUDT20) in Complex with Z296300542

All present enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of DCP2 (NUDT20) in Complex with Z296300542:
3.6.1.62;

Protein crystallography data

The structure of Pandda Analysis Group Deposition -- Crystal Structure of DCP2 (NUDT20) in Complex with Z296300542, PDB code: 5qou was solved by E.R.Nelson, S.Velupillai, R.Talon, P.M.Collins, T.Krojer, D.Wang, J.Brandao-Neto, A.Douangamath, N.Burgess-Brown, C.H.Arrowsmith, C.Bountra, K.Huber, F.Von Delft, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 44.52 / 2.19
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 48.268, 60.447, 65.695, 90.00, 90.00, 90.00
R / Rfree (%) 19.5 / 25.2

Fluorine Binding Sites:

The binding sites of Fluorine atom in the Pandda Analysis Group Deposition -- Crystal Structure of DCP2 (NUDT20) in Complex with Z296300542 (pdb code 5qou). 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 Pandda Analysis Group Deposition -- Crystal Structure of DCP2 (NUDT20) in Complex with Z296300542, PDB code: 5qou:

Fluorine binding site 1 out of 1 in 5qou

Go back to Fluorine Binding Sites List in 5qou
Fluorine binding site 1 out of 1 in the Pandda Analysis Group Deposition -- Crystal Structure of DCP2 (NUDT20) in Complex with Z296300542


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Pandda Analysis Group Deposition -- Crystal Structure of DCP2 (NUDT20) in Complex with Z296300542 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F306

b:36.0
occ:0.42
 F1 A:LE7306 0.0 36.0 0.4
C12 A:LE7306 1.4 36.2 0.4
C13 A:LE7306 2.3 34.5 0.4
C11 A:LE7306 2.3 35.7 0.4
OE2 A:GLU148 3.1 46.1 1.0
CD A:GLU148 3.2 47.6 1.0
CD1 A:ILE194 3.4 38.6 1.0
C14 A:LE7306 3.6 34.9 0.4
C10 A:LE7306 3.6 35.2 0.4
OE1 A:GLU148 3.6 43.9 1.0
CG A:GLU148 3.6 40.6 1.0
O A:HOH456 3.7 61.7 1.0
NZ A:LYS121 3.7 56.4 0.4
C9 A:LE7306 4.1 35.2 0.4
CE A:LYS121 4.3 56.1 0.4
CG1 A:ILE194 4.4 39.4 1.0
O A:LYS128 4.6 36.8 1.0
O A:GLU193 4.7 46.0 0.4
CB A:GLU148 4.8 38.3 1.0
O A:HOH403 4.8 65.8 1.0
CB A:GLU193 5.0 55.3 0.4

Reference:

E.R.Nelson, S.Velupillai, R.Talon, P.M.Collins, T.Krojer, D.Wang, J.Brandao-Neto, A.Douangamath, N.Burgess-Brown, C.H.Arrowsmith, C.Bountra, K.Huber, F.Von Delft. Pandda Analysis Group Deposition To Be Published.
Page generated: Thu Aug 1 13:20:56 2024

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