Magnesium in PDB 6okh: Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197)
Protein crystallography data
The structure of Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197), PDB code: 6okh
was solved by
Seattle Structural Genomics Center For Infectious Disease (Ssgcid),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
45.84 /
1.85
|
Space group
|
C 2 2 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
74.880,
101.120,
108.660,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
16.9 /
20
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197)
(pdb code 6okh). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the
Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197), PDB code: 6okh:
Jump to Magnesium binding site number:
1;
2;
3;
4;
Magnesium binding site 1 out
of 4 in 6okh
Go back to
Magnesium Binding Sites List in 6okh
Magnesium binding site 1 out
of 4 in the Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197)
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg200
b:13.9
occ:1.00
|
OD2
|
A:ASP79
|
2.1
|
14.9
|
1.0
|
O
|
A:HOH323
|
2.1
|
17.4
|
1.0
|
O
|
A:HOH312
|
2.1
|
15.5
|
1.0
|
O
|
A:ILE106
|
2.1
|
16.1
|
1.0
|
O
|
A:HOH318
|
2.1
|
15.5
|
1.0
|
NE2
|
A:HIS38
|
2.2
|
16.6
|
1.0
|
CG
|
A:ASP79
|
3.0
|
18.7
|
1.0
|
CE1
|
A:HIS38
|
3.2
|
17.1
|
1.0
|
CD2
|
A:HIS38
|
3.2
|
19.7
|
1.0
|
C
|
A:ILE106
|
3.3
|
15.6
|
1.0
|
OD1
|
A:ASP79
|
3.3
|
17.8
|
1.0
|
MG
|
A:MG201
|
3.6
|
36.1
|
1.0
|
N
|
A:ILE106
|
3.8
|
11.1
|
1.0
|
CA
|
A:ILE106
|
3.9
|
11.6
|
1.0
|
CB
|
A:ILE106
|
4.0
|
16.1
|
1.0
|
O
|
A:HOH373
|
4.1
|
30.8
|
1.0
|
OD2
|
A:ASP115
|
4.2
|
16.6
|
1.0
|
OG
|
A:SER108
|
4.2
|
17.1
|
0.6
|
O
|
A:HOH313
|
4.2
|
17.8
|
1.0
|
O
|
A:HOH303
|
4.3
|
40.3
|
1.0
|
ND1
|
A:HIS38
|
4.3
|
15.6
|
1.0
|
O
|
A:HOH334
|
4.4
|
16.7
|
1.0
|
N
|
A:LEU107
|
4.4
|
13.9
|
1.0
|
CG
|
A:HIS38
|
4.4
|
18.3
|
1.0
|
CB
|
A:ASP79
|
4.4
|
13.9
|
1.0
|
OE1
|
A:GLU105
|
4.4
|
14.8
|
1.0
|
O
|
A:HOH439
|
4.6
|
39.4
|
1.0
|
CA
|
A:LEU107
|
4.6
|
15.9
|
1.0
|
C
|
A:LEU107
|
4.7
|
22.9
|
1.0
|
C
|
A:GLU105
|
4.8
|
11.0
|
1.0
|
N
|
A:SER108
|
4.8
|
18.0
|
1.0
|
CG2
|
A:ILE106
|
4.9
|
13.3
|
1.0
|
CG1
|
A:ILE106
|
5.0
|
21.4
|
1.0
|
|
Magnesium binding site 2 out
of 4 in 6okh
Go back to
Magnesium Binding Sites List in 6okh
Magnesium binding site 2 out
of 4 in the Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197)
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg201
b:36.1
occ:1.00
|
O
|
A:HOH334
|
2.2
|
16.7
|
1.0
|
O
|
A:HOH397
|
2.2
|
27.5
|
1.0
|
O
|
A:HOH316
|
2.3
|
22.9
|
1.0
|
O
|
A:HOH318
|
2.5
|
15.5
|
1.0
|
O
|
A:HOH373
|
2.7
|
30.8
|
1.0
|
O
|
A:HOH312
|
2.7
|
15.5
|
1.0
|
O
|
A:HOH323
|
3.5
|
17.4
|
1.0
|
MG
|
A:MG200
|
3.6
|
13.9
|
1.0
|
NZ
|
A:LYS119
|
3.9
|
16.2
|
1.0
|
O
|
A:HOH322
|
4.0
|
35.3
|
1.0
|
O
|
A:HOH374
|
4.1
|
36.9
|
1.0
|
OE1
|
A:GLU105
|
4.1
|
14.8
|
1.0
|
OD1
|
A:ASP115
|
4.2
|
17.4
|
1.0
|
OD2
|
A:ASP115
|
4.3
|
16.6
|
1.0
|
OE1
|
A:GLU22
|
4.3
|
34.6
|
1.0
|
O
|
A:HOH439
|
4.3
|
39.4
|
1.0
|
OD1
|
A:ASN111
|
4.4
|
40.7
|
1.0
|
CG2
|
A:VAL31
|
4.4
|
53.3
|
1.0
|
OD1
|
A:ASP79
|
4.4
|
17.8
|
1.0
|
OD2
|
A:ASP79
|
4.5
|
14.9
|
1.0
|
O
|
A:GLN77
|
4.5
|
17.4
|
1.0
|
O
|
A:HOH313
|
4.6
|
17.8
|
1.0
|
CG
|
A:ASP115
|
4.7
|
17.4
|
1.0
|
CG
|
A:ASP79
|
4.8
|
18.7
|
1.0
|
OE2
|
A:GLU22
|
4.8
|
21.7
|
1.0
|
CD
|
A:GLU105
|
4.9
|
14.3
|
1.0
|
CD
|
A:GLU22
|
4.9
|
28.7
|
1.0
|
|
Magnesium binding site 3 out
of 4 in 6okh
Go back to
Magnesium Binding Sites List in 6okh
Magnesium binding site 3 out
of 4 in the Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197)
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg200
b:18.1
occ:1.00
|
OD2
|
B:ASP79
|
2.1
|
16.6
|
1.0
|
O
|
B:HOH338
|
2.1
|
18.1
|
1.0
|
O
|
B:ILE106
|
2.2
|
17.7
|
1.0
|
O
|
B:HOH313
|
2.2
|
17.2
|
1.0
|
NE2
|
B:HIS38
|
2.3
|
20.8
|
1.0
|
O
|
B:HOH314
|
2.3
|
19.5
|
1.0
|
CG
|
B:ASP79
|
3.0
|
19.2
|
1.0
|
CE1
|
B:HIS38
|
3.2
|
20.5
|
1.0
|
C
|
B:ILE106
|
3.3
|
18.3
|
1.0
|
OD1
|
B:ASP79
|
3.3
|
19.1
|
1.0
|
CD2
|
B:HIS38
|
3.3
|
16.2
|
1.0
|
MG
|
B:MG201
|
3.5
|
31.6
|
1.0
|
N
|
B:ILE106
|
3.7
|
15.4
|
1.0
|
CA
|
B:ILE106
|
3.9
|
16.0
|
1.0
|
O
|
B:HOH399
|
4.0
|
28.7
|
1.0
|
O
|
B:HOH303
|
4.0
|
30.1
|
1.0
|
CB
|
B:ILE106
|
4.0
|
20.1
|
1.0
|
OD2
|
B:ASP115
|
4.2
|
18.9
|
1.0
|
O
|
B:HOH335
|
4.3
|
18.0
|
1.0
|
O
|
B:HOH333
|
4.3
|
19.5
|
1.0
|
ND1
|
B:HIS38
|
4.3
|
19.4
|
1.0
|
OG
|
B:SER108
|
4.3
|
36.8
|
1.0
|
N
|
B:LEU107
|
4.4
|
18.4
|
1.0
|
CB
|
B:ASP79
|
4.4
|
14.3
|
1.0
|
OE1
|
B:GLU105
|
4.4
|
14.6
|
1.0
|
CG
|
B:HIS38
|
4.4
|
15.8
|
1.0
|
C
|
B:LEU107
|
4.7
|
26.2
|
1.0
|
CA
|
B:LEU107
|
4.7
|
20.2
|
1.0
|
O
|
B:HOH408
|
4.7
|
35.0
|
1.0
|
C
|
B:GLU105
|
4.8
|
16.9
|
1.0
|
N
|
B:SER108
|
4.9
|
19.9
|
1.0
|
CG2
|
B:ILE106
|
4.9
|
18.0
|
1.0
|
CG1
|
B:ILE106
|
5.0
|
27.3
|
1.0
|
|
Magnesium binding site 4 out
of 4 in 6okh
Go back to
Magnesium Binding Sites List in 6okh
Magnesium binding site 4 out
of 4 in the Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197)
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg201
b:31.6
occ:1.00
|
O
|
B:HOH335
|
2.2
|
18.0
|
1.0
|
O
|
B:HOH423
|
2.3
|
31.6
|
1.0
|
O
|
B:HOH325
|
2.4
|
30.5
|
1.0
|
O
|
B:HOH314
|
2.4
|
19.5
|
1.0
|
O
|
B:HOH399
|
2.5
|
28.7
|
1.0
|
O
|
B:HOH313
|
2.5
|
17.2
|
1.0
|
MG
|
B:MG200
|
3.5
|
18.1
|
1.0
|
O
|
B:HOH338
|
3.5
|
18.1
|
1.0
|
NZ
|
B:LYS119
|
3.9
|
20.7
|
1.0
|
OE1
|
B:GLU105
|
4.1
|
14.6
|
1.0
|
OD1
|
B:ASP115
|
4.1
|
19.2
|
1.0
|
OD2
|
B:ASP115
|
4.1
|
18.9
|
1.0
|
O
|
B:HOH341
|
4.2
|
39.9
|
1.0
|
O
|
B:HOH329
|
4.3
|
40.8
|
1.0
|
OD1
|
B:ASP79
|
4.4
|
19.1
|
1.0
|
OD2
|
B:ASP79
|
4.4
|
16.6
|
1.0
|
O
|
B:HOH408
|
4.5
|
35.0
|
1.0
|
O
|
B:GLN77
|
4.5
|
21.3
|
1.0
|
CG2
|
B:VAL31
|
4.5
|
51.9
|
1.0
|
O
|
B:HOH333
|
4.5
|
19.5
|
1.0
|
OD1
|
B:ASN111
|
4.5
|
49.9
|
1.0
|
CG
|
B:ASP115
|
4.6
|
19.8
|
1.0
|
OE1
|
B:GLU22
|
4.7
|
37.2
|
1.0
|
CG
|
B:ASP79
|
4.7
|
19.2
|
1.0
|
O
|
B:HOH429
|
4.8
|
49.6
|
1.0
|
CD
|
B:GLU105
|
4.8
|
17.4
|
1.0
|
OE2
|
B:GLU22
|
5.0
|
25.5
|
1.0
|
|
Reference:
J.Abendroth,
P.S.Horanyi,
D.D.Lorimer,
T.E.Edwards.
Structure of An Uncharacterized Protein From Leptospira Borgpetersenii Serovar Hardjo-Bovis (Strain JB197) To Be Published.
Page generated: Tue Oct 1 13:24:18 2024
|