Magnesium in PDB 6rde: Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor
Enzymatic activity of Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor
All present enzymatic activity of Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor:
7.1.2.2;
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor
(pdb code 6rde). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 5 binding sites of Magnesium where determined in the
Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor, PDB code: 6rde:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
Magnesium binding site 1 out
of 5 in 6rde
Go back to
Magnesium Binding Sites List in 6rde
Magnesium binding site 1 out
of 5 in the Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1002
b:15.0
occ:1.00
|
O
|
T:HOH1101
|
2.2
|
30.0
|
1.0
|
O2B
|
T:ATP1001
|
2.4
|
29.9
|
1.0
|
O1G
|
T:ATP1001
|
2.4
|
29.9
|
1.0
|
OG1
|
T:THR232
|
2.5
|
13.0
|
1.0
|
O
|
T:HOH1108
|
2.5
|
30.0
|
1.0
|
CB
|
T:THR232
|
3.7
|
13.0
|
1.0
|
OD2
|
T:ASP325
|
3.7
|
16.0
|
1.0
|
PB
|
T:ATP1001
|
3.7
|
29.9
|
1.0
|
PG
|
T:ATP1001
|
3.8
|
29.9
|
1.0
|
O
|
T:HOH1103
|
4.1
|
30.0
|
1.0
|
O3B
|
T:ATP1001
|
4.1
|
29.9
|
1.0
|
O
|
T:HOH1104
|
4.2
|
30.0
|
1.0
|
OD1
|
T:ASP325
|
4.2
|
16.0
|
1.0
|
CG
|
T:ASP325
|
4.3
|
16.0
|
1.0
|
CG2
|
T:THR232
|
4.5
|
13.0
|
1.0
|
O1B
|
T:ATP1001
|
4.6
|
29.9
|
1.0
|
N
|
T:THR232
|
4.7
|
13.0
|
1.0
|
O
|
T:HOH1110
|
4.7
|
30.0
|
1.0
|
O2G
|
T:ATP1001
|
4.7
|
29.9
|
1.0
|
CA
|
T:THR232
|
4.7
|
13.0
|
1.0
|
O
|
X:HOH604
|
4.8
|
30.0
|
1.0
|
O3G
|
T:ATP1001
|
4.8
|
29.9
|
1.0
|
O3A
|
T:ATP1001
|
4.8
|
29.9
|
1.0
|
O
|
T:HOH1102
|
4.9
|
30.0
|
1.0
|
OD2
|
T:ASP326
|
4.9
|
11.8
|
1.0
|
O2A
|
T:ATP1001
|
5.0
|
29.9
|
1.0
|
|
Magnesium binding site 2 out
of 5 in 6rde
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Magnesium Binding Sites List in 6rde
Magnesium binding site 2 out
of 5 in the Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
U:Mg1002
b:13.6
occ:1.00
|
O
|
U:HOH1104
|
1.7
|
30.0
|
1.0
|
OG1
|
U:THR232
|
2.1
|
19.0
|
1.0
|
O1B
|
U:ATP1001
|
2.1
|
29.1
|
1.0
|
O
|
U:HOH1108
|
2.6
|
30.0
|
1.0
|
O1G
|
U:ATP1001
|
2.9
|
29.1
|
1.0
|
O
|
U:HOH1101
|
3.1
|
30.0
|
1.0
|
O3G
|
U:ATP1001
|
3.2
|
29.1
|
1.0
|
PB
|
U:ATP1001
|
3.4
|
29.1
|
1.0
|
CB
|
U:THR232
|
3.5
|
19.0
|
1.0
|
OD1
|
U:ASP325
|
3.5
|
18.2
|
1.0
|
OD2
|
U:ASP325
|
3.5
|
18.2
|
1.0
|
PG
|
U:ATP1001
|
3.5
|
29.1
|
1.0
|
O
|
U:HOH1103
|
3.7
|
30.0
|
1.0
|
CG
|
U:ASP325
|
3.9
|
18.2
|
1.0
|
O3B
|
U:ATP1001
|
4.0
|
29.1
|
1.0
|
O2B
|
U:ATP1001
|
4.0
|
29.1
|
1.0
|
N
|
U:THR232
|
4.0
|
19.0
|
1.0
|
CA
|
U:THR232
|
4.2
|
19.0
|
1.0
|
CG2
|
U:THR232
|
4.3
|
19.0
|
1.0
|
O3A
|
U:ATP1001
|
4.7
|
29.1
|
1.0
|
O2A
|
U:ATP1001
|
4.9
|
29.1
|
1.0
|
CE
|
U:LYS231
|
4.9
|
18.6
|
1.0
|
OD2
|
U:ASP326
|
4.9
|
15.3
|
1.0
|
O2G
|
U:ATP1001
|
5.0
|
29.1
|
1.0
|
C
|
U:LYS231
|
5.0
|
18.6
|
1.0
|
CB
|
U:LYS231
|
5.0
|
18.6
|
1.0
|
|
Magnesium binding site 3 out
of 5 in 6rde
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Magnesium Binding Sites List in 6rde
Magnesium binding site 3 out
of 5 in the Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
V:Mg1002
b:13.2
occ:1.00
|
O
|
V:HOH1104
|
1.7
|
30.0
|
1.0
|
OG1
|
V:THR232
|
2.0
|
13.8
|
1.0
|
O
|
V:HOH1107
|
2.5
|
30.0
|
1.0
|
O3B
|
V:ATP1001
|
3.0
|
24.7
|
1.0
|
O
|
V:HOH1106
|
3.1
|
30.0
|
1.0
|
OD1
|
V:ASP325
|
3.5
|
8.2
|
1.0
|
CB
|
V:THR232
|
3.5
|
13.8
|
1.0
|
O2G
|
V:ATP1001
|
3.5
|
24.7
|
1.0
|
O
|
V:HOH1102
|
3.7
|
30.0
|
1.0
|
PG
|
V:ATP1001
|
3.8
|
24.7
|
1.0
|
O2B
|
V:ATP1001
|
3.9
|
24.7
|
1.0
|
PB
|
V:ATP1001
|
3.9
|
24.7
|
1.0
|
OD2
|
V:ASP325
|
4.0
|
8.2
|
1.0
|
O3A
|
V:ATP1001
|
4.1
|
24.7
|
1.0
|
O1G
|
V:ATP1001
|
4.1
|
24.7
|
1.0
|
CG
|
V:ASP325
|
4.1
|
8.2
|
1.0
|
CG2
|
V:THR232
|
4.2
|
13.8
|
1.0
|
N
|
V:THR232
|
4.2
|
13.8
|
1.0
|
CA
|
V:THR232
|
4.3
|
13.8
|
1.0
|
OD1
|
V:ASP326
|
4.4
|
8.2
|
1.0
|
OD2
|
V:ASP326
|
4.5
|
8.2
|
1.0
|
CG
|
V:ASP326
|
4.8
|
8.2
|
1.0
|
CE
|
V:LYS231
|
5.0
|
13.6
|
1.0
|
|
Magnesium binding site 4 out
of 5 in 6rde
Go back to
Magnesium Binding Sites List in 6rde
Magnesium binding site 4 out
of 5 in the Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
Y:Mg602
b:10.2
occ:1.00
|
O3B
|
Y:ADP601
|
2.1
|
17.0
|
1.0
|
OG1
|
Y:THR190
|
2.1
|
11.0
|
1.0
|
OE1
|
Y:GLU215
|
3.0
|
10.6
|
1.0
|
CB
|
Y:THR190
|
3.3
|
11.0
|
1.0
|
PB
|
Y:ADP601
|
3.4
|
17.0
|
1.0
|
OE2
|
Y:GLU219
|
3.7
|
11.7
|
1.0
|
O2B
|
Y:ADP601
|
3.9
|
17.0
|
1.0
|
CG2
|
Y:THR190
|
3.9
|
11.0
|
1.0
|
OE1
|
Y:GLU219
|
3.9
|
11.7
|
1.0
|
CD
|
Y:GLU215
|
4.0
|
10.6
|
1.0
|
CD
|
Y:GLU219
|
4.3
|
11.7
|
1.0
|
OD1
|
Y:ASP285
|
4.3
|
10.2
|
1.0
|
O1B
|
Y:ADP601
|
4.3
|
17.0
|
1.0
|
NH1
|
Y:ARG216
|
4.4
|
11.4
|
1.0
|
O2A
|
Y:ADP601
|
4.4
|
17.0
|
1.0
|
O3A
|
Y:ADP601
|
4.5
|
17.0
|
1.0
|
CA
|
Y:THR190
|
4.5
|
11.0
|
1.0
|
N
|
Y:THR190
|
4.5
|
11.0
|
1.0
|
OD2
|
Y:ASP285
|
4.6
|
10.2
|
1.0
|
CG
|
Y:GLU215
|
4.7
|
10.6
|
1.0
|
PA
|
Y:ADP601
|
4.7
|
17.0
|
1.0
|
OE2
|
Y:GLU215
|
4.8
|
10.6
|
1.0
|
ND2
|
Y:ASN286
|
4.8
|
12.0
|
1.0
|
CG
|
Y:ASP285
|
4.8
|
10.2
|
1.0
|
O1A
|
Y:ADP601
|
4.9
|
17.0
|
1.0
|
NZ
|
Y:LYS189
|
5.0
|
11.2
|
1.0
|
|
Magnesium binding site 5 out
of 5 in 6rde
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Magnesium Binding Sites List in 6rde
Magnesium binding site 5 out
of 5 in the Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Cryoem Structure of Polytomella F-Atp Synthase, Primary Rotary State 2, Focussed Refinement of F1 Head and Rotor within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
Z:Mg602
b:28.9
occ:1.00
|
OG1
|
Z:THR190
|
2.1
|
30.0
|
1.0
|
O3B
|
Z:ADP601
|
2.2
|
35.2
|
1.0
|
OE1
|
Z:GLU215
|
2.7
|
17.4
|
1.0
|
OE2
|
Z:GLU219
|
3.3
|
20.4
|
1.0
|
CB
|
Z:THR190
|
3.4
|
30.0
|
1.0
|
CD
|
Z:GLU215
|
3.6
|
17.4
|
1.0
|
PB
|
Z:ADP601
|
3.6
|
35.2
|
1.0
|
NH1
|
Z:ARG216
|
3.7
|
17.6
|
1.0
|
O2A
|
Z:ADP601
|
4.1
|
35.2
|
1.0
|
OE2
|
Z:GLU215
|
4.1
|
17.4
|
1.0
|
CG2
|
Z:THR190
|
4.1
|
30.0
|
1.0
|
CD
|
Z:GLU219
|
4.2
|
20.4
|
1.0
|
OD1
|
Z:ASP285
|
4.3
|
17.6
|
1.0
|
OE1
|
Z:GLU219
|
4.3
|
20.4
|
1.0
|
NH2
|
V:ARG429
|
4.3
|
31.5
|
1.0
|
O2B
|
Z:ADP601
|
4.4
|
35.2
|
1.0
|
CA
|
Z:THR190
|
4.4
|
30.0
|
1.0
|
O1B
|
Z:ADP601
|
4.5
|
35.2
|
1.0
|
N
|
Z:THR190
|
4.5
|
30.0
|
1.0
|
O3A
|
Z:ADP601
|
4.5
|
35.2
|
1.0
|
CG
|
Z:GLU215
|
4.6
|
17.4
|
1.0
|
PA
|
Z:ADP601
|
4.7
|
35.2
|
1.0
|
OD2
|
Z:ASP285
|
4.8
|
17.6
|
1.0
|
CZ
|
Z:ARG216
|
4.9
|
17.6
|
1.0
|
CG
|
Z:ASP285
|
5.0
|
17.6
|
1.0
|
|
Reference:
B.J.Murphy,
N.Klusch,
J.Langer,
D.J.Mills,
O.Yildiz,
W.Kuhlbrandt.
Rotary Substates of Mitochondrial Atp Synthase Reveal the Basis of Flexible F1-Focoupling. Science V. 364 2019.
ISSN: ESSN 1095-9203
PubMed: 31221832
DOI: 10.1126/SCIENCE.AAW9128
Page generated: Tue Oct 1 16:43:01 2024
|