Atomistry » Magnesium » PDB 7v09-7vdo » 7v3c
Atomistry »
  Magnesium »
    PDB 7v09-7vdo »
      7v3c »

Magnesium in PDB 7v3c: Crystal Structure of Np Exonuclease C409A-Pcmb Complex

Protein crystallography data

The structure of Crystal Structure of Np Exonuclease C409A-Pcmb Complex, PDB code: 7v3c was solved by Y.Y.Hsiao, K.W.Huang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 26.44 / 1.90
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 123.851, 58.809, 68.845, 90, 90, 90
R / Rfree (%) 18.7 / 22.2

Other elements in 7v3c:

The structure of Crystal Structure of Np Exonuclease C409A-Pcmb Complex also contains other interesting chemical elements:

Zinc (Zn) 2 atoms
Mercury (Hg) 1 atom

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of Np Exonuclease C409A-Pcmb Complex (pdb code 7v3c). 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 Np Exonuclease C409A-Pcmb Complex, PDB code: 7v3c:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 7v3c

Go back to Magnesium Binding Sites List in 7v3c
Magnesium binding site 1 out of 2 in the Crystal Structure of Np Exonuclease C409A-Pcmb Complex


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 Np Exonuclease C409A-Pcmb Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg602

b:46.5
occ:1.00
OD2 A:ASP533 2.0 38.3 1.0
O A:HOH764 2.1 39.8 1.0
O A:HOH709 2.3 45.5 1.0
OD2 A:ASP389 2.3 39.7 1.0
O A:HOH759 2.3 41.5 1.0
O A:HOH703 3.0 55.8 1.0
CG A:ASP389 3.1 36.1 1.0
CG A:ASP533 3.1 35.9 1.0
OD1 A:ASP389 3.2 37.4 1.0
O A:HOH704 3.6 47.2 1.0
CB A:ASP533 3.7 25.3 1.0
OE2 A:GLU391 4.0 41.1 1.0
O A:HOH702 4.0 53.3 1.0
NH2 A:ARG492 4.1 45.7 1.0
O A:HOH794 4.1 46.8 1.0
OD1 A:ASP533 4.2 33.8 1.0
CZ A:PHE537 4.3 29.4 1.0
CE2 A:PHE537 4.3 28.5 1.0
O A:ILE390 4.5 28.6 1.0
CB A:ASP389 4.6 20.5 1.0

Magnesium binding site 2 out of 2 in 7v3c

Go back to Magnesium Binding Sites List in 7v3c
Magnesium binding site 2 out of 2 in the Crystal Structure of Np Exonuclease C409A-Pcmb Complex


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 Np Exonuclease C409A-Pcmb Complex within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg603

b:41.4
occ:1.00
O B:HOH709 1.9 35.4 1.0
OD2 B:ASP533 2.0 36.7 1.0
O B:HOH701 2.0 42.2 1.0
O B:HOH729 2.1 34.7 1.0
O B:HOH768 2.2 43.5 1.0
OD2 B:ASP389 2.3 49.9 1.0
CG B:ASP533 3.1 32.8 1.0
CG B:ASP389 3.3 41.5 1.0
OE2 B:GLU391 3.3 45.0 1.0
OD1 B:ASP389 3.6 45.1 1.0
CB B:ASP533 3.7 26.6 1.0
NH2 B:ARG492 4.1 45.1 1.0
OD1 B:ASP533 4.1 34.0 1.0
O B:ILE390 4.2 28.7 1.0
CD B:GLU391 4.5 39.8 1.0
CB B:ASP389 4.6 24.5 1.0
O B:CYS529 4.6 25.1 1.0
CZ B:PHE537 4.7 34.2 1.0
CE2 B:PHE537 4.7 33.3 1.0
CB B:HIS528 4.7 31.4 1.0
CA B:ALA530 4.8 25.2 1.0

Reference:

K.W.Huang, J.W.Chen, T.Y.Hua, Y.Y.Chu, T.Y.Chiu, J.Y.Liu, C.I.Tu, K.C.Hsu, Y.T.Kao, J.W.Chu, Y.Y.Hsiao. Targeted Covalent Inhibitors Allosterically Deactivate the Deddhlassa Fever Virus Np Exonuclease From Alternative Distal Site. Jacs Au 2021.
ISSN: ESSN 2691-3704
DOI: 10.1021/JACSAU.1C00420
Page generated: Thu Oct 3 10:21:50 2024

Last articles

F in 7HNS
F in 7HOG
F in 7HO4
F in 7HOL
F in 7HNQ
F in 7HMA
F in 7HNA
F in 7HMV
F in 7HMO
F in 7HN0
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy