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Magnesium in PDB 7r0t: Crystal Structure of Exonuclease EXNV1

Protein crystallography data

The structure of Crystal Structure of Exonuclease EXNV1, PDB code: 7r0t was solved by M.Welin, A.Svensson, M.Hakansson, S.Al-Karadaghi, A.Jasilionis, J.A.Linares-Pasten, L.Wang, E.Nordberg Karlsson, J.Ahlqvist, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 45.78 / 2.19
Space group P 21 2 21
Cell size a, b, c (Å), α, β, γ (°) 42.279, 54.11, 171.732, 90, 90, 90
R / Rfree (%) 23.5 / 27.8

Other elements in 7r0t:

The structure of Crystal Structure of Exonuclease EXNV1 also contains other interesting chemical elements:

Terbium (Tb) 1 atom
Chlorine (Cl) 4 atoms

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of Exonuclease EXNV1 (pdb code 7r0t). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Crystal Structure of Exonuclease EXNV1, PDB code: 7r0t:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 7r0t

Go back to Magnesium Binding Sites List in 7r0t
Magnesium binding site 1 out of 2 in the Crystal Structure of Exonuclease EXNV1


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Crystal Structure of Exonuclease EXNV1 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg402

b:66.6
occ:1.00
OE2 A:GLU34 2.1 59.6 1.0
OD2 A:ASP32 2.1 54.6 1.0
OD2 A:ASP252 2.1 55.1 1.0
O2P A:TMP401 2.1 60.9 1.0
O1P A:TMP401 2.6 62.4 1.0
P A:TMP401 2.8 61.8 1.0
CG A:ASP32 3.1 53.4 1.0
CD A:GLU34 3.1 58.3 1.0
CG A:ASP252 3.1 53.3 1.0
O A:HOH506 3.4 40.5 1.0
OD1 A:ASP32 3.4 53.3 1.0
CB A:ASP252 3.5 48.7 1.0
OE1 A:GLU34 3.6 58.8 1.0
MG A:MG403 3.6 45.9 1.0
O3P A:TMP401 3.8 61.8 1.0
O5' A:TMP401 4.1 61.5 1.0
O A:THR33 4.1 53.0 1.0
CE2 A:TYR248 4.1 59.6 1.0
OH A:TYR248 4.2 62.2 1.0
OD1 A:ASP252 4.3 53.4 1.0
C5' A:TMP401 4.3 61.1 1.0
CG A:GLU34 4.4 53.3 1.0
CB A:ASP32 4.4 50.6 1.0
CZ A:TYR248 4.4 60.8 1.0
O A:HOH514 4.6 44.1 1.0
O A:HOH501 4.6 45.0 1.0
CA A:ALA249 4.7 52.3 1.0
O A:HOH519 4.8 40.8 1.0
NZ A:LYS140 4.8 64.5 1.0
O A:ALA249 4.8 51.7 1.0
C A:THR33 4.9 51.6 1.0
CD2 A:TYR248 5.0 58.4 1.0

Magnesium binding site 2 out of 2 in 7r0t

Go back to Magnesium Binding Sites List in 7r0t
Magnesium binding site 2 out of 2 in the Crystal Structure of Exonuclease EXNV1


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Crystal Structure of Exonuclease EXNV1 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg403

b:45.9
occ:1.00
O A:HOH514 2.1 44.1 1.0
O A:HOH510 2.1 41.1 1.0
O2P A:TMP401 2.1 60.9 1.0
O A:HOH506 2.1 40.5 1.0
O A:HOH519 2.1 40.8 1.0
OD1 A:ASP32 2.1 53.3 1.0
CG A:ASP32 3.2 53.4 1.0
P A:TMP401 3.3 61.8 1.0
MG A:MG402 3.6 66.6 1.0
OD2 A:ASP32 3.6 54.6 1.0
O3P A:TMP401 3.7 61.8 1.0
C5' A:TMP401 3.9 61.1 1.0
O5' A:TMP401 3.9 61.5 1.0
OD1 A:ASP104 4.0 53.2 1.0
O A:THR33 4.0 53.0 1.0
O A:HOH525 4.1 48.4 1.0
O A:HOH507 4.1 32.2 1.0
O A:HOH501 4.2 45.0 1.0
OD2 A:ASP104 4.2 54.9 1.0
O A:HOH545 4.2 67.3 1.0
O A:HIS99 4.4 50.6 1.0
N A:THR33 4.5 51.0 1.0
CB A:ASP32 4.5 50.6 1.0
CG A:ASP104 4.5 52.8 1.0
O1P A:TMP401 4.6 62.4 1.0
CA A:ASP32 4.8 49.5 1.0
OD2 A:ASP252 4.8 55.1 1.0

Reference:

J.Ahlqvist, J.A.Linares-Pasten, A.Jasilionis, M.Welin, M.Hakansson, L.A.Svensson, L.Wang, H.Watzlawick, A.Aevarsson, O.H.Fridjonsson, G.O.Hreggvidsson, B.Ketelsen Striberny, E.Glomsaker, O.Lanes, S.Al-Karadaghi, E.Nordberg Karlsson. Crystal Structure of Dna Polymerase I From Thermus Phage G20C. Acta Crystallogr D Struct V. 78 1384 2022BIOL.
PubMed: 36322421
DOI: 10.1107/S2059798322009895
Page generated: Thu Oct 3 07:05:22 2024

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