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Magnesium in PDB 5ouo: Structure of TGPLP1 Apcbeta Domain

Protein crystallography data

The structure of Structure of TGPLP1 Apcbeta Domain, PDB code: 5ouo was solved by T.Ni, R.J.C.Gilbert, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 50.37 / 1.11
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 100.760, 50.210, 52.280, 90.00, 90.96, 90.00
R / Rfree (%) 14.9 / 16.7

Other elements in 5ouo:

The structure of Structure of TGPLP1 Apcbeta Domain also contains other interesting chemical elements:

Chlorine (Cl) 1 atom

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Structure of TGPLP1 Apcbeta Domain (pdb code 5ouo). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Structure of TGPLP1 Apcbeta Domain, PDB code: 5ouo:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 5ouo

Go back to Magnesium Binding Sites List in 5ouo
Magnesium binding site 1 out of 2 in the Structure of TGPLP1 Apcbeta Domain


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Structure of TGPLP1 Apcbeta Domain within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1101

b:15.8
occ:1.00
H A:ASN983 2.2 12.3 1.0
H A:THR948 2.4 11.1 1.0
HA A:VAL982 2.8 14.2 1.0
O A:HOH1396 2.8 20.9 1.0
HD22 A:ASN983 3.0 13.4 1.0
HA A:THR947 3.0 11.6 1.0
HG23 A:VAL982 3.0 18.6 1.0
N A:ASN983 3.0 10.3 1.0
O A:HOH1235 3.0 27.8 1.0
HG23 A:THR947 3.2 14.6 1.0
HB2 A:ASN983 3.2 12.2 1.0
N A:THR948 3.2 9.2 1.0
HB A:THR948 3.4 11.2 1.0
OG1 A:THR948 3.4 10.9 1.0
CA A:VAL982 3.6 11.8 1.0
CG2 A:VAL982 3.8 15.5 1.0
ND2 A:ASN983 3.8 11.1 1.0
HG22 A:VAL982 3.8 18.6 1.0
CB A:THR948 3.8 9.3 1.0
C A:VAL982 3.8 12.6 1.0
CA A:THR947 3.8 9.7 1.0
CB A:ASN983 3.9 10.1 1.0
CG2 A:THR947 4.0 12.1 1.0
CA A:ASN983 4.0 10.0 1.0
C A:THR947 4.0 9.6 1.0
HG22 A:THR947 4.1 14.6 1.0
HG1 A:THR948 4.1 13.0 1.0
CA A:THR948 4.1 8.9 1.0
O A:ASN983 4.2 11.5 1.0
CB A:VAL982 4.2 14.3 1.0
HG1 A:THR947 4.2 17.2 1.0
CG A:ASN983 4.4 9.7 1.0
HD21 A:ASN983 4.4 13.4 1.0
O A:CYS946 4.4 14.2 1.0
CB A:THR947 4.4 9.9 1.0
HB A:VAL982 4.5 17.2 1.0
O A:LEU981 4.5 14.6 1.0
HG21 A:VAL982 4.6 18.6 1.0
C A:ASN983 4.6 9.8 1.0
O A:HOH1254 4.7 24.8 1.0
N A:VAL982 4.7 11.9 1.0
HB3 A:ASN983 4.7 12.2 1.0
HG21 A:THR947 4.7 14.6 1.0
HA A:ASN983 4.8 12.0 1.0
OG1 A:THR947 4.8 14.3 1.0
O A:THR948 4.8 10.6 1.0
HA A:THR948 4.8 10.7 1.0
N A:THR947 5.0 9.8 1.0
C A:THR948 5.0 9.8 1.0

Magnesium binding site 2 out of 2 in 5ouo

Go back to Magnesium Binding Sites List in 5ouo
Magnesium binding site 2 out of 2 in the Structure of TGPLP1 Apcbeta Domain


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Structure of TGPLP1 Apcbeta Domain within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1102

b:30.8
occ:0.65
O A:HOH1229 1.9 45.2 1.0
OE1 A:GLU986 2.2 22.1 1.0
O A:HOH1473 2.2 43.3 1.0
O A:HOH1244 2.2 33.9 1.0
O A:HOH1471 2.3 47.7 1.0
CD A:GLU986 3.1 33.7 1.0
O A:HOH1418 3.3 30.7 1.0
OE2 A:GLU986 3.4 20.7 1.0
H A:LEU987 4.0 13.9 1.0
O A:HOH1433 4.0 35.5 1.0
HA A:GLU986 4.0 13.7 1.0
O A:HOH1587 4.1 48.1 1.0
O A:LEU987 4.3 12.5 1.0
CG A:GLU986 4.5 17.3 1.0
N A:LEU987 4.6 11.6 1.0
HB2 A:GLU986 4.7 15.8 1.0
HG3 A:GLU986 4.8 20.7 1.0
CA A:GLU986 4.8 11.4 1.0
CB A:GLU986 4.9 13.1 1.0

Reference:

T.Ni, S.I.Williams, S.Rezelj, G.Anderluh, K.Harlos, P.J.Stansfeld, R.J.C.Gilbert. Structures of Monomeric and Oligomeric Forms of Thetoxoplasma Gondiiperforin-Like Protein 1. Sci Adv V. 4 Q0762 2018.
ISSN: ESSN 2375-2548
PubMed: 29750191
DOI: 10.1126/SCIADV.AAQ0762
Page generated: Mon Sep 30 01:23:41 2024

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