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Gold 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:

Magnesium (Mg) 3 atoms

Gold Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 11;

Binding sites:

The binding sites of Gold 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 Gold atom.
In total 11 binding sites of Gold where determined in the Structure of the OSR1 Kinase, A Hypertension Drug Target, PDB code: 2vwi:
Jump to Gold binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Gold binding site 1 out of 11 in 2vwi

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Gold binding site 1 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au 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
A:Au1293

b:35.9
occ:0.50
 SG C:CYS70 2.0 52.0 1.0
CB C:CYS70 3.4 51.1 1.0
O C:ALA66 3.4 50.7 1.0
CG C:GLN142 3.6 47.9 1.0
N C:CYS70 3.7 51.3 1.0
NE2 C:GLN142 3.9 48.4 1.0
CA C:CYS70 3.9 51.3 1.0
CD C:GLN142 4.0 48.3 1.0
CB C:GLN69 4.0 51.6 1.0
CA C:ALA66 4.0 50.9 1.0
C C:GLN69 4.1 51.5 1.0
C C:ALA66 4.2 50.8 1.0
CB C:ALA66 4.2 50.9 1.0
NE2 C:GLN69 4.3 52.9 1.0
CB C:ASN140 4.3 47.9 1.0
CA C:GLN69 4.6 51.6 1.0
OD1 C:ASN140 4.7 49.7 1.0
O C:GLN69 4.7 51.6 1.0
CG C:ASN140 4.8 48.5 1.0
OE1 C:GLN142 4.8 48.3 1.0
CB C:GLN142 4.9 47.7 1.0
CZ C:PHE165 4.9 47.8 1.0
O C:ASN140 4.9 47.9 1.0

Gold binding site 2 out of 11 in 2vwi

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Gold binding site 2 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au 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
A:Au1295

b:56.8
occ:0.50
 SG A:CYS70 2.2 55.2 1.0
N A:CYS70 3.4 54.8 1.0
CB A:CYS70 3.6 54.3 1.0
CG A:GLN142 3.7 45.5 1.0
CA A:CYS70 3.8 54.2 1.0
N A:GLN69 3.9 56.3 1.0
NE2 A:GLN142 4.0 47.5 1.0
CB A:ASN140 4.0 44.1 1.0
CD A:GLN142 4.1 46.7 1.0
C A:GLN69 4.1 55.4 1.0
CA A:GLN69 4.4 55.8 1.0
CG A:ASN140 4.5 44.3 1.0
CB A:GLN69 4.5 55.9 1.0
N A:SER68 4.7 57.2 1.0
O A:ASN140 4.7 44.2 1.0
ND2 A:ASN140 4.8 44.5 1.0
C A:SER68 4.8 56.7 1.0
CA A:SER68 4.8 56.9 1.0
OE1 A:GLN142 4.9 47.4 1.0

Gold binding site 3 out of 11 in 2vwi

Go back to Gold Binding Sites List in 2vwi
Gold binding site 3 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au 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
A:Au1296

b:48.0
occ:0.50
 SG A:CYS191 2.0 42.0 1.0
CB A:CYS191 3.2 40.6 1.0
N A:CYS191 3.5 40.7 1.0
CD A:PRO190 3.6 41.6 1.0
CA A:CYS191 3.8 40.4 1.0
N A:PRO190 4.1 41.7 1.0
CB A:THR189 4.3 42.5 1.0
C A:THR189 4.4 42.1 1.0
CA A:THR189 4.4 42.5 1.0
C A:PRO190 4.6 41.0 1.0
CG A:PRO190 4.8 41.5 1.0
CZ3 A:TRP192 4.8 37.3 1.0
CA A:PRO190 4.9 41.4 1.0
CG2 A:THR189 4.9 42.6 1.0

Gold binding site 4 out of 11 in 2vwi

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Gold binding site 4 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 4 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Au1294

b:39.1
occ:0.50
 SG D:CYS191 2.3 40.3 1.0
CB D:CYS191 3.3 39.4 1.0
N D:CYS191 3.3 39.5 1.0
CA D:CYS191 3.9 39.4 1.0
CG2 D:THR189 4.1 40.5 1.0
CB D:PRO190 4.2 40.1 1.0
CZ3 D:TRP192 4.3 36.6 1.0
CD D:PRO190 4.4 40.2 1.0
C D:PRO190 4.4 39.7 1.0
N D:PRO190 4.4 40.2 1.0
CA D:PRO190 4.5 40.0 1.0
CG D:PRO190 4.6 40.2 1.0
CE3 D:TRP192 4.7 36.5 1.0
C D:THR189 4.8 40.5 1.0

Gold binding site 5 out of 11 in 2vwi

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Gold binding site 5 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 5 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Au1296

b:55.5
occ:0.50
 SG B:CYS191 2.3 45.8 1.0
CB B:CYS191 3.1 45.0 1.0
CZ3 B:TRP192 3.6 42.8 1.0
CH2 B:TRP192 3.7 42.7 1.0
CG2 B:THR189 4.5 48.2 1.0
CA B:CYS191 4.5 45.1 1.0
CE3 B:TRP192 4.5 42.6 1.0
CZ2 B:TRP192 4.7 42.7 1.0
N B:CYS191 4.8 45.5 1.0

Gold binding site 6 out of 11 in 2vwi

Go back to Gold Binding Sites List in 2vwi
Gold binding site 6 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 6 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Au1297

b:78.3
occ:0.50
 SG B:CYS70 2.3 49.6 1.0
O B:ALA66 3.3 54.5 1.0
NE2 B:GLN142 3.6 45.0 1.0
CG B:GLN142 3.6 45.8 1.0
CB B:GLN69 3.8 52.8 1.0
CB B:CYS70 3.9 51.5 1.0
N B:CYS70 3.9 51.9 1.0
NE2 B:GLN69 3.9 53.5 1.0
CD B:GLN142 3.9 45.5 1.0
CB B:ASN140 4.0 46.9 1.0
CA B:CYS70 4.2 51.4 1.0
C B:ALA66 4.2 54.8 1.0
C B:GLN69 4.3 52.4 1.0
CA B:ALA66 4.3 55.1 1.0
CB B:ALA66 4.5 55.2 1.0
CG B:ASN140 4.5 47.3 1.0
CA B:GLN69 4.6 52.8 1.0
O B:ASN140 4.8 46.9 1.0
CD B:GLN69 4.8 53.1 1.0
OE1 B:GLN142 4.9 44.3 1.0
CE2 B:PHE165 4.9 49.0 1.0
OD1 B:ASN140 4.9 48.1 1.0
O B:GLN69 4.9 52.5 1.0
CZ B:PHE165 4.9 49.1 1.0
CG B:GLN69 4.9 52.9 1.0
CB B:GLN142 5.0 46.4 1.0

Gold binding site 7 out of 11 in 2vwi

Go back to Gold Binding Sites List in 2vwi
Gold binding site 7 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 7 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Au1298

b:69.4
occ:0.50
 SG B:CYS53 2.8 69.0 1.0
CG2 B:ILE48 3.5 64.2 1.0
CD1 B:LEU171 3.6 58.2 1.0
CB B:ALA29 3.9 63.9 1.0
CB B:LEU171 4.1 58.5 1.0
CG1 B:ILE48 4.2 64.1 1.0
CB B:CYS53 4.2 68.4 1.0
N B:ALA29 4.4 63.9 1.0
CB B:ILE48 4.4 64.1 1.0
CG B:LEU171 4.5 58.5 1.0
CD1 B:ILE48 4.5 64.1 1.0
CA B:ALA29 4.6 63.9 1.0

Gold binding site 8 out of 11 in 2vwi

Go back to Gold Binding Sites List in 2vwi
Gold binding site 8 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 8 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Au1295

b:65.8
occ:0.50
 SG C:CYS191 2.4 44.0 1.0
CB C:CYS191 3.3 42.9 1.0
CB C:THR189 3.5 45.7 1.0
CZ3 C:TRP192 3.6 40.5 1.0
CG2 C:THR189 3.8 45.9 1.0
CH2 C:TRP192 4.0 40.5 1.0
CA C:THR189 4.2 45.6 1.0
N C:CYS191 4.3 43.2 1.0
C C:THR189 4.4 45.2 1.0
CE3 C:TRP192 4.5 40.5 1.0
CA C:CYS191 4.5 42.9 1.0
OG1 C:THR189 4.6 45.8 1.0
O C:THR189 4.6 45.2 1.0
N C:PRO190 4.9 44.7 1.0

Gold binding site 9 out of 11 in 2vwi

Go back to Gold Binding Sites List in 2vwi
Gold binding site 9 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 9 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Au1296

b:57.6
occ:0.50
 SG C:CYS53 2.6 58.3 1.0
CA C:CYS53 3.3 57.2 1.0
O C:LYS52 3.4 56.5 1.0
N C:CYS53 3.4 56.7 1.0
C C:LYS52 3.5 56.4 1.0
CA C:THR28 3.5 56.0 1.0
CB C:CYS53 3.5 57.2 1.0
CB C:THR28 3.7 56.2 1.0
O C:ALA27 3.9 56.6 1.0
OG1 C:THR28 4.0 56.9 1.0
CB C:LYS52 4.1 56.0 1.0
N C:THR28 4.2 56.2 1.0
C C:ALA27 4.3 56.4 1.0
CA C:LYS52 4.4 56.0 1.0
O C:THR28 4.5 55.8 1.0
C C:THR28 4.6 55.6 1.0
C C:CYS53 4.7 57.2 1.0
O C:ASN49 5.0 51.5 1.0

Gold binding site 10 out of 11 in 2vwi

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Gold binding site 10 out of 11 in the Structure of the OSR1 Kinase, A Hypertension Drug Target


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 10 of Structure of the OSR1 Kinase, A Hypertension Drug Target within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Au1301

b:36.4
occ:0.50
 SG D:CYS70 1.9 49.9 1.0
O D:HOH2007 2.9 28.1 1.0
CB D:CYS70 3.5 50.2 1.0
CG D:GLN142 3.5 45.8 1.0
O D:ALA66 3.5 51.3 1.0
N D:CYS70 3.7 50.1 1.0
CD D:GLN142 3.8 46.0 1.0
NE2 D:GLN142 3.9 46.6 1.0
CA D:CYS70 3.9 50.2 1.0
ND2 D:ASN140 4.0 46.4 1.0
CB D:GLN69 4.0 50.2 1.0
CB D:ASN140 4.1 44.9 1.0
C D:GLN69 4.2 50.2 1.0
C D:ALA66 4.3 51.4 1.0
CA D:ALA66 4.3 51.8 1.0
CB D:ALA66 4.4 51.8 1.0
OE1 D:GLN142 4.5 46.6 1.0
CG D:ASN140 4.6 45.5 1.0
O D:ASN140 4.7 45.2 1.0
CA D:GLN69 4.7 50.2 1.0
O D:GLN69 4.8 50.2 1.0
CZ D:PHE165 4.8 46.0 1.0
CB D:GLN142 4.9 45.5 1.0
CE2 D:PHE165 4.9 45.8 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: Wed Jul 10 14:13:08 2024

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