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Magnesium in PDB 2vwi: Structure of the OSR1 Kinase, A Hypertension Drug Target

Enzymatic activity of Structure of the OSR1 Kinase, A Hypertension Drug Target

All present enzymatic activity of Structure of the OSR1 Kinase, A Hypertension Drug Target:
2.7.11.1;

Protein crystallography data

The structure of Structure of the OSR1 Kinase, A Hypertension Drug Target, PDB code: 2vwi was solved by F.Villa, M.Deak, D.R.Alessi, D.M.F.Vanaalten, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 19.94 / 2.15
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 74.130, 99.900, 158.525, 90.00, 90.00, 90.00
R / Rfree (%) 25.3 / 28.7

Other elements in 2vwi:

The structure of Structure of the OSR1 Kinase, A Hypertension Drug Target also contains other interesting chemical elements:

Gold (Au) 11 atoms

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Structure of the OSR1 Kinase, A Hypertension Drug Target (pdb code 2vwi). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 3 binding sites of Magnesium where determined in the Structure of the OSR1 Kinase, A Hypertension Drug Target, PDB code: 2vwi:
Jump to Magnesium binding site number: 1; 2; 3;

Magnesium binding site 1 out of 3 in 2vwi

Go back to Magnesium Binding Sites List in 2vwi
Magnesium binding site 1 out of 3 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg1293

b:58.4
occ:1.00
N3B B:ANP1295 1.9 65.0 1.0
OD1 B:ASN151 2.2 47.6 1.0
OD2 B:ASP164 2.2 50.8 1.0
O1A B:ANP1295 2.4 62.3 1.0
O2G B:ANP1295 3.1 65.7 1.0
PG B:ANP1295 3.1 65.4 1.0
PB B:ANP1295 3.2 64.5 1.0
O1B B:ANP1295 3.3 64.8 1.0
CG B:ASP164 3.3 49.9 1.0
CG B:ASN151 3.4 47.7 1.0
PA B:ANP1295 3.6 62.4 1.0
O3A B:ANP1295 3.8 63.5 1.0
OD1 B:ASP164 3.9 50.5 1.0
ND2 B:ASN151 4.0 47.7 1.0
O B:GLY150 4.0 47.2 1.0
O3G B:ANP1295 4.1 65.5 1.0
O1G B:ANP1295 4.2 65.4 1.0
NZ B:LYS46 4.3 63.6 1.0
O5' B:ANP1295 4.3 61.0 1.0
O2B B:ANP1295 4.4 64.6 1.0
CB B:ASP164 4.4 49.6 1.0
CB B:ASN151 4.5 47.5 1.0
CA B:ASN151 4.6 47.5 1.0
C B:GLY150 4.6 47.3 1.0
O2A B:ANP1295 4.9 62.3 1.0
N B:ASN151 4.9 47.3 1.0

Magnesium binding site 2 out of 3 in 2vwi

Go back to Magnesium Binding Sites List in 2vwi
Magnesium binding site 2 out of 3 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Mg1293

b:40.3
occ:1.00
O1A C:ANP1294 2.0 35.4 1.0
OD2 C:ASP164 2.1 48.4 1.0
ND2 C:ASN151 2.2 45.9 1.0
O1B C:ANP1294 3.0 42.5 1.0
N3B C:ANP1294 3.3 44.1 1.0
CG C:ASP164 3.3 47.8 1.0
PA C:ANP1294 3.4 35.6 1.0
CG C:ASN151 3.4 46.4 1.0
PB C:ANP1294 3.6 42.6 1.0
O3A C:ANP1294 3.9 39.4 1.0
OD1 C:ASN151 4.0 47.0 1.0
OD1 C:ASP164 4.0 48.6 1.0
NZ C:LYS46 4.0 48.3 1.0
O5' C:ANP1294 4.1 34.1 1.0
O C:HOH2029 4.2 31.6 1.0
O C:GLY150 4.3 46.0 1.0
CB C:ASP164 4.3 47.5 1.0
O C:HOH2034 4.3 32.3 1.0
NZ C:LYS148 4.4 49.6 1.0
O2A C:ANP1294 4.5 35.7 1.0
CB C:ASN151 4.6 46.4 1.0
CA C:ASN151 4.6 46.4 1.0
C C:GLY150 4.8 46.1 1.0
PG C:ANP1294 4.8 46.0 1.0
N C:ASN151 4.9 46.2 1.0

Magnesium binding site 3 out of 3 in 2vwi

Go back to Magnesium Binding Sites List in 2vwi
Magnesium binding site 3 out of 3 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 3 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Mg1299

b:42.2
occ:1.00
OD1 D:ASN151 2.2 47.1 1.0
OD2 D:ASP164 2.3 46.7 1.0
O1A D:ANP1300 2.4 49.7 1.0
O1B D:ANP1300 3.1 54.8 1.0
CG D:ASP164 3.3 46.1 1.0
CG D:ASN151 3.4 47.1 1.0
O D:GLY150 3.7 47.4 1.0
PA D:ANP1300 3.8 49.9 1.0
OD1 D:ASP164 4.0 46.2 1.0
NZ D:LYS46 4.1 56.0 1.0
ND2 D:ASN151 4.1 46.5 1.0
PB D:ANP1300 4.2 55.0 1.0
O D:HOH2035 4.3 27.5 1.0
N3B D:ANP1300 4.3 56.3 1.0
CB D:ASP164 4.3 46.2 1.0
C D:GLY150 4.3 47.4 1.0
O5' D:ANP1300 4.4 48.0 1.0
CA D:ASN151 4.5 47.3 1.0
CB D:ASN151 4.5 47.2 1.0
O3A D:ANP1300 4.5 52.6 1.0
N D:ASN151 4.7 47.3 1.0
O2A D:ANP1300 5.0 50.1 1.0

Reference:

F.Villa, M.Deak, D.R.Alessi, D.M.F.Van Aalten. Structure of the OSR1 Kinase, A Hypertension Drug Target. Proteins V. 73 1082 2008.
ISSN: ISSN 0887-3585
PubMed: 18831043
DOI: 10.1002/PROT.22238
Page generated: Mon Dec 14 07:43:15 2020

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