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Bromine in PDB 3esd: Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid

Enzymatic activity of Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid

All present enzymatic activity of Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid:
3.1.1.74;

Protein crystallography data

The structure of Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid, PDB code: 3esd was solved by L.Rutten, J.P.B.A.Mannie, M.Lutz, P.Gros, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 41.00 / 1.22
Space group H 3
Cell size a, b, c (Å), α, β, γ (°) 72.360, 72.360, 110.770, 90.00, 90.00, 120.00
R / Rfree (%) 19.9 / 22.2

Other elements in 3esd:

The structure of Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid also contains other interesting chemical elements:

Palladium (Pd) 1 atom

Bromine Binding Sites:

The binding sites of Bromine atom in the Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid (pdb code 3esd). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total only one binding site of Bromine was determined in the Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid, PDB code: 3esd:

Bromine binding site 1 out of 1 in 3esd

Go back to Bromine Binding Sites List in 3esd
Bromine binding site 1 out of 1 in the Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Cut-2B; Ncn-Pt-Pincer-Cutinase Hybrid within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Br215

b:62.6
occ:1.00
BR1 A:SXC215 0.0 62.6 1.0
PD1 A:SXC215 2.5 21.2 1.0
S1 A:SXC215 3.5 23.0 1.0
S2 A:SXC215 3.5 21.9 1.0
C9 A:SXC215 3.6 42.6 1.0
C12 A:SXC215 3.7 20.2 1.0
C1 A:SXC215 4.5 8.8 1.0

Reference:

L.Rutten, B.Wieczorek, J.P.B.A.Mannie, C.A.Kruithof, H.P.Dijkstra, M.R.Egmond, M.Lutz, R.J.M.Klein Gebbink, P.Gros, G.Van Koten. Solid-State Structural Characterization of Cutinase-Ece-Pincer-Metal Hybrids Chemistry V. 15 4270 2009.
ISSN: ISSN 0947-6539
PubMed: 19219875
DOI: 10.1002/CHEM.200801995
Page generated: Sat Dec 12 02:11:43 2020

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