Magnesium in PDB 6qs7: Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
(pdb code 6qs7). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 8 binding sites of Magnesium where determined in the
Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A, PDB code: 6qs7:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Magnesium binding site 1 out
of 8 in 6qs7
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Magnesium Binding Sites List in 6qs7
Magnesium binding site 1 out
of 8 in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg1002
b:0.9
occ:1.00
|
O2G
|
A:AGS1001
|
2.1
|
0.3
|
1.0
|
OG1
|
A:THR213
|
2.4
|
0.1
|
1.0
|
O1B
|
A:AGS1001
|
3.3
|
0.3
|
1.0
|
PG
|
A:AGS1001
|
3.6
|
0.3
|
1.0
|
CB
|
A:THR213
|
3.7
|
0.1
|
1.0
|
O3G
|
A:AGS1001
|
4.1
|
0.3
|
1.0
|
N
|
A:THR213
|
4.2
|
0.1
|
1.0
|
O1A
|
A:AGS1001
|
4.2
|
0.3
|
1.0
|
PB
|
A:AGS1001
|
4.4
|
0.3
|
1.0
|
O3B
|
A:AGS1001
|
4.5
|
0.3
|
1.0
|
CA
|
A:THR213
|
4.5
|
0.1
|
1.0
|
O2A
|
A:AGS1001
|
4.6
|
0.3
|
1.0
|
CG2
|
A:THR213
|
4.7
|
0.1
|
1.0
|
S1G
|
A:AGS1001
|
4.7
|
0.3
|
1.0
|
PA
|
A:AGS1001
|
4.7
|
0.3
|
1.0
|
O3A
|
A:AGS1001
|
4.8
|
0.3
|
1.0
|
CB
|
A:ASP278
|
4.9
|
97.5
|
1.0
|
|
Magnesium binding site 2 out
of 8 in 6qs7
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Magnesium Binding Sites List in 6qs7
Magnesium binding site 2 out
of 8 in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg1003
b:67.5
occ:1.00
|
O1B
|
B:AGS1001
|
2.1
|
76.4
|
1.0
|
O2G
|
B:AGS1001
|
2.1
|
76.4
|
1.0
|
OG1
|
B:THR213
|
2.3
|
71.4
|
1.0
|
PG
|
B:AGS1001
|
3.2
|
76.4
|
1.0
|
PB
|
B:AGS1001
|
3.3
|
76.4
|
1.0
|
O3G
|
B:AGS1001
|
3.6
|
76.4
|
1.0
|
CB
|
B:THR213
|
3.6
|
71.4
|
1.0
|
O3B
|
B:AGS1001
|
3.7
|
76.4
|
1.0
|
NH1
|
A:ARG332
|
4.1
|
80.1
|
1.0
|
O2B
|
B:AGS1001
|
4.2
|
76.4
|
1.0
|
N
|
B:THR213
|
4.3
|
71.4
|
1.0
|
CA
|
B:THR213
|
4.5
|
71.4
|
1.0
|
O3A
|
B:AGS1001
|
4.5
|
76.4
|
1.0
|
CG2
|
B:THR213
|
4.5
|
71.4
|
1.0
|
O2A
|
B:AGS1001
|
4.6
|
76.4
|
1.0
|
O1A
|
B:AGS1001
|
4.8
|
76.4
|
1.0
|
CB
|
B:ASP278
|
4.9
|
73.2
|
1.0
|
S1G
|
B:AGS1001
|
4.9
|
76.4
|
1.0
|
PA
|
B:AGS1001
|
4.9
|
76.4
|
1.0
|
|
Magnesium binding site 3 out
of 8 in 6qs7
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Magnesium Binding Sites List in 6qs7
Magnesium binding site 3 out
of 8 in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg1004
b:0.6
occ:1.00
|
OG1
|
B:THR612
|
2.1
|
0.1
|
1.0
|
O1B
|
B:AGS1002
|
2.1
|
0.9
|
1.0
|
O2G
|
B:AGS1002
|
2.7
|
0.9
|
1.0
|
OD1
|
B:ASP677
|
3.2
|
99.3
|
1.0
|
CB
|
B:THR612
|
3.3
|
0.1
|
1.0
|
PB
|
B:AGS1002
|
3.6
|
0.9
|
1.0
|
PG
|
B:AGS1002
|
4.1
|
0.9
|
1.0
|
CG2
|
B:THR612
|
4.2
|
0.1
|
1.0
|
N
|
B:THR612
|
4.2
|
0.1
|
1.0
|
CG
|
B:ASP677
|
4.2
|
99.3
|
1.0
|
O2A
|
B:AGS1002
|
4.3
|
0.9
|
1.0
|
CA
|
B:THR612
|
4.3
|
0.1
|
1.0
|
O3B
|
B:AGS1002
|
4.3
|
0.9
|
1.0
|
O3A
|
B:AGS1002
|
4.3
|
0.9
|
1.0
|
O1A
|
B:AGS1002
|
4.4
|
0.9
|
1.0
|
O2B
|
B:AGS1002
|
4.5
|
0.9
|
1.0
|
OD2
|
B:ASP677
|
4.5
|
99.3
|
1.0
|
PA
|
B:AGS1002
|
4.6
|
0.9
|
1.0
|
OG1
|
B:THR717
|
4.7
|
93.4
|
1.0
|
NH2
|
B:ARG815
|
4.8
|
0.3
|
1.0
|
NH2
|
A:ARG756
|
4.8
|
0.7
|
1.0
|
|
Magnesium binding site 4 out
of 8 in 6qs7
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Magnesium Binding Sites List in 6qs7
Magnesium binding site 4 out
of 8 in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg1003
b:57.5
occ:1.00
|
O1B
|
C:AGS1001
|
2.0
|
68.3
|
1.0
|
OG1
|
C:THR213
|
2.1
|
65.9
|
1.0
|
O2G
|
C:AGS1001
|
2.5
|
68.3
|
1.0
|
CB
|
C:THR213
|
3.4
|
65.9
|
1.0
|
PB
|
C:AGS1001
|
3.5
|
68.3
|
1.0
|
PG
|
C:AGS1001
|
3.9
|
68.3
|
1.0
|
CG2
|
C:THR213
|
4.0
|
65.9
|
1.0
|
O3A
|
C:AGS1001
|
4.2
|
68.3
|
1.0
|
O3B
|
C:AGS1001
|
4.2
|
68.3
|
1.0
|
N
|
C:THR213
|
4.4
|
65.9
|
1.0
|
CA
|
C:THR213
|
4.5
|
65.9
|
1.0
|
O2B
|
C:AGS1001
|
4.5
|
68.3
|
1.0
|
NH1
|
B:ARG332
|
4.8
|
61.0
|
1.0
|
O3G
|
C:AGS1001
|
4.9
|
68.3
|
1.0
|
CB
|
C:ASP278
|
4.9
|
78.2
|
1.0
|
|
Magnesium binding site 5 out
of 8 in 6qs7
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Magnesium Binding Sites List in 6qs7
Magnesium binding site 5 out
of 8 in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg1004
b:84.2
occ:1.00
|
OG1
|
C:THR612
|
2.1
|
82.8
|
1.0
|
O1B
|
C:AGS1002
|
2.4
|
88.1
|
1.0
|
OD1
|
C:ASP677
|
2.4
|
77.8
|
1.0
|
OD2
|
C:ASP677
|
2.4
|
77.8
|
1.0
|
O2G
|
C:AGS1002
|
2.6
|
88.1
|
1.0
|
CG
|
C:ASP677
|
2.7
|
77.8
|
1.0
|
CB
|
C:THR612
|
3.5
|
82.8
|
1.0
|
OG1
|
C:THR717
|
3.6
|
71.1
|
1.0
|
PB
|
C:AGS1002
|
3.8
|
88.1
|
1.0
|
N
|
C:THR612
|
4.0
|
82.8
|
1.0
|
PG
|
C:AGS1002
|
4.0
|
88.1
|
1.0
|
CB
|
C:THR717
|
4.2
|
71.1
|
1.0
|
CA
|
C:THR612
|
4.2
|
82.8
|
1.0
|
CB
|
C:ASP677
|
4.2
|
77.8
|
1.0
|
CG2
|
C:THR612
|
4.3
|
82.8
|
1.0
|
O3B
|
C:AGS1002
|
4.3
|
88.1
|
1.0
|
CB
|
C:LYS611
|
4.4
|
78.5
|
1.0
|
CG2
|
C:THR717
|
4.5
|
71.1
|
1.0
|
O2B
|
C:AGS1002
|
4.6
|
88.1
|
1.0
|
O2A
|
C:AGS1002
|
4.8
|
88.1
|
1.0
|
O3A
|
C:AGS1002
|
4.8
|
88.1
|
1.0
|
C
|
C:LYS611
|
4.9
|
78.5
|
1.0
|
O3G
|
C:AGS1002
|
4.9
|
88.1
|
1.0
|
O1A
|
C:AGS1002
|
4.9
|
88.1
|
1.0
|
N
|
C:ALA678
|
5.0
|
78.2
|
1.0
|
CA
|
C:ASP677
|
5.0
|
77.8
|
1.0
|
|
Magnesium binding site 6 out
of 8 in 6qs7
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Magnesium Binding Sites List in 6qs7
Magnesium binding site 6 out
of 8 in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg1003
b:68.0
occ:1.00
|
O1B
|
D:AGS1001
|
2.1
|
73.8
|
1.0
|
O2G
|
D:AGS1001
|
2.1
|
73.8
|
1.0
|
OG1
|
D:THR213
|
2.3
|
75.2
|
1.0
|
PG
|
D:AGS1001
|
3.2
|
73.8
|
1.0
|
S1G
|
D:AGS1001
|
3.3
|
73.8
|
1.0
|
PB
|
D:AGS1001
|
3.4
|
73.8
|
1.0
|
CB
|
D:THR213
|
3.6
|
75.2
|
1.0
|
O3B
|
D:AGS1001
|
3.9
|
73.8
|
1.0
|
O1A
|
D:AGS1001
|
4.2
|
73.8
|
1.0
|
NH1
|
C:ARG332
|
4.3
|
66.1
|
1.0
|
N
|
D:THR213
|
4.4
|
75.2
|
1.0
|
O2B
|
D:AGS1001
|
4.4
|
73.8
|
1.0
|
O3A
|
D:AGS1001
|
4.4
|
73.8
|
1.0
|
CG2
|
D:THR213
|
4.5
|
75.2
|
1.0
|
O3G
|
D:AGS1001
|
4.5
|
73.8
|
1.0
|
CA
|
D:THR213
|
4.6
|
75.2
|
1.0
|
PA
|
D:AGS1001
|
4.9
|
73.8
|
1.0
|
|
Magnesium binding site 7 out
of 8 in 6qs7
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Magnesium Binding Sites List in 6qs7
Magnesium binding site 7 out
of 8 in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 7 of Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg1004
b:72.4
occ:1.00
|
OG1
|
D:THR612
|
2.1
|
77.2
|
1.0
|
O1B
|
D:AGS1002
|
2.7
|
81.6
|
1.0
|
CB
|
D:THR612
|
3.0
|
77.2
|
1.0
|
OD1
|
D:ASP677
|
3.2
|
69.8
|
1.0
|
O1A
|
D:AGS1002
|
3.2
|
81.6
|
1.0
|
OD2
|
D:ASP677
|
3.3
|
69.8
|
1.0
|
CG2
|
D:THR612
|
3.6
|
77.2
|
1.0
|
CG
|
D:ASP677
|
3.7
|
69.8
|
1.0
|
OD2
|
C:ASP695
|
4.0
|
71.4
|
1.0
|
PB
|
D:AGS1002
|
4.0
|
81.6
|
1.0
|
CA
|
D:THR612
|
4.3
|
77.2
|
1.0
|
PA
|
D:AGS1002
|
4.4
|
81.6
|
1.0
|
O2G
|
D:AGS1002
|
4.5
|
81.6
|
1.0
|
N
|
D:THR612
|
4.5
|
77.2
|
1.0
|
NH2
|
D:ARG631
|
4.6
|
70.1
|
1.0
|
O3A
|
D:AGS1002
|
4.6
|
81.6
|
1.0
|
O2B
|
D:AGS1002
|
4.6
|
81.6
|
1.0
|
NH2
|
D:ARG815
|
4.9
|
80.1
|
1.0
|
O3G
|
D:AGS1002
|
4.9
|
81.6
|
1.0
|
NH2
|
C:ARG756
|
5.0
|
71.0
|
1.0
|
|
Magnesium binding site 8 out
of 8 in 6qs7
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Magnesium Binding Sites List in 6qs7
Magnesium binding site 8 out
of 8 in the Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 8 of Clpb (Dwb and K476C Mutant) Bound to Casein in Presence of Atpgammas - State Kc-2A within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg1003
b:81.0
occ:1.00
|
OG1
|
E:THR612
|
2.0
|
87.3
|
1.0
|
O2G
|
E:AGS1002
|
2.1
|
89.7
|
1.0
|
OD1
|
E:ASP677
|
2.9
|
76.3
|
1.0
|
PG
|
E:AGS1002
|
3.4
|
89.7
|
1.0
|
CB
|
E:THR612
|
3.4
|
87.3
|
1.0
|
OD2
|
E:ASP677
|
3.5
|
76.3
|
1.0
|
O3G
|
E:AGS1002
|
3.5
|
89.7
|
1.0
|
CG
|
E:ASP677
|
3.6
|
76.3
|
1.0
|
O1A
|
E:AGS1002
|
3.7
|
89.7
|
1.0
|
OG1
|
E:THR717
|
4.0
|
77.7
|
1.0
|
CG2
|
E:THR612
|
4.1
|
87.3
|
1.0
|
N
|
E:THR612
|
4.2
|
87.3
|
1.0
|
NH2
|
D:ARG756
|
4.3
|
76.4
|
1.0
|
O3B
|
E:AGS1002
|
4.3
|
89.7
|
1.0
|
CA
|
E:THR612
|
4.3
|
87.3
|
1.0
|
CB
|
E:THR717
|
4.5
|
77.7
|
1.0
|
PA
|
E:AGS1002
|
4.7
|
89.7
|
1.0
|
S1G
|
E:AGS1002
|
4.7
|
89.7
|
1.0
|
CG2
|
E:THR717
|
4.7
|
77.7
|
1.0
|
CB
|
E:LYS611
|
4.8
|
87.7
|
1.0
|
O2A
|
E:AGS1002
|
4.8
|
89.7
|
1.0
|
OD2
|
D:ASP695
|
4.8
|
77.5
|
1.0
|
O3A
|
E:AGS1002
|
4.9
|
89.7
|
1.0
|
|
Reference:
C.Deville,
K.Franke,
A.Mogk,
B.Bukau,
H.R.Saibil.
Two-Step Activation Mechanism of the Clpb Disaggregase For Sequential Substrate Threading By the Main Atpase Motor. Cell Rep V. 27 3433 2019.
ISSN: ESSN 2211-1247
PubMed: 31216466
DOI: 10.1016/J.CELREP.2019.05.075
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