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Manganese in PDB 5tzk: Crystal Structure of S. Aureus Tars 1-349 in Complex with Udp

Protein crystallography data

The structure of Crystal Structure of S. Aureus Tars 1-349 in Complex with Udp, PDB code: 5tzk was solved by L.J.Worrall, S.Sobhanifar, D.T.King, N.C.Strynadka, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 28.28 / 2.22
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 53.070, 60.190, 65.390, 90.00, 101.51, 90.00
R / Rfree (%) 17.6 / 21.9

Manganese Binding Sites:

The binding sites of Manganese atom in the Crystal Structure of S. Aureus Tars 1-349 in Complex with Udp (pdb code 5tzk). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total only one binding site of Manganese was determined in the Crystal Structure of S. Aureus Tars 1-349 in Complex with Udp, PDB code: 5tzk:

Manganese binding site 1 out of 1 in 5tzk

Go back to Manganese Binding Sites List in 5tzk
Manganese binding site 1 out of 1 in the Crystal Structure of S. Aureus Tars 1-349 in Complex with Udp


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Crystal Structure of S. Aureus Tars 1-349 in Complex with Udp within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Mn402

b:30.9
occ:1.00
O2A C:UDP401 2.0 38.0 1.0
O C:HOH539 2.1 31.0 1.0
O1B C:UDP401 2.1 40.0 1.0
OD2 C:ASP93 2.3 28.7 1.0
O C:HOH525 2.3 22.8 1.0
OD1 C:ASP93 2.4 26.6 1.0
CG C:ASP93 2.6 28.2 1.0
PA C:UDP401 3.3 37.5 1.0
PB C:UDP401 3.3 39.3 1.0
O3A C:UDP401 3.6 38.8 1.0
NH2 C:ARG126 3.7 66.2 1.0
O5' C:UDP401 3.8 38.7 1.0
O3B C:UDP401 4.0 39.2 1.0
OD1 C:ASP94 4.1 25.3 1.0
O C:HOH595 4.1 38.2 1.0
CB C:ASP93 4.1 29.4 1.0
OD2 C:ASP94 4.2 22.9 1.0
OD2 C:ASP91 4.3 28.2 1.0
CB C:ASP91 4.3 25.2 1.0
O1A C:UDP401 4.4 38.7 1.0
O2B C:UDP401 4.4 40.3 1.0
CG C:ASP94 4.4 24.3 1.0
CG C:ASP91 4.8 26.0 1.0
CZ C:ARG126 4.9 63.1 1.0
CA C:ASP93 5.0 28.3 1.0
N C:ASP93 5.0 26.6 1.0

Reference:

S.Sobhanifar, L.J.Worrall, D.T.King, G.A.Wasney, L.Baumann, R.T.Gale, M.Nosella, E.D.Brown, S.G.Withers, N.C.Strynadka. Structure and Mechanism of Staphylococcus Aureus Tars, the Wall Teichoic Acid Beta-Glycosyltransferase Involved in Methicillin Resistance. Plos Pathog. V. 12 06067 2016.
ISSN: ESSN 1553-7374
PubMed: 27973583
DOI: 10.1371/JOURNAL.PPAT.1006067
Page generated: Tue Dec 15 04:46:58 2020

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