Magnesium in PDB 8v9r: Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx
Enzymatic activity of Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx
All present enzymatic activity of Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx:
3.4.21.92;
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx
(pdb code 8v9r). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the
Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx, PDB code: 8v9r:
Jump to Magnesium binding site number:
1;
2;
3;
4;
Magnesium binding site 1 out
of 4 in 8v9r
Go back to
Magnesium Binding Sites List in 8v9r
Magnesium binding site 1 out
of 4 in the Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg501
b:87.2
occ:1.00
|
HG1
|
A:THR126
|
1.9
|
90.8
|
1.0
|
O2B
|
A:ATP500
|
2.0
|
84.9
|
1.0
|
O2G
|
A:ATP500
|
2.1
|
84.9
|
1.0
|
OG1
|
A:THR126
|
2.3
|
90.8
|
1.0
|
OD2
|
A:ASP184
|
3.1
|
97.4
|
1.0
|
PB
|
A:ATP500
|
3.3
|
84.9
|
1.0
|
PG
|
A:ATP500
|
3.4
|
84.9
|
1.0
|
HB
|
A:THR126
|
3.4
|
90.8
|
1.0
|
CB
|
A:THR126
|
3.5
|
90.8
|
1.0
|
O1A
|
A:ATP500
|
3.5
|
84.9
|
1.0
|
O3B
|
A:ATP500
|
3.6
|
84.9
|
1.0
|
H
|
A:THR126
|
3.8
|
90.8
|
1.0
|
CG
|
A:ASP184
|
4.0
|
97.4
|
1.0
|
HG21
|
A:THR126
|
4.0
|
90.8
|
1.0
|
OD1
|
A:ASP184
|
4.1
|
97.4
|
1.0
|
HH22
|
B:ARG307
|
4.1
|
79.0
|
1.0
|
HE2
|
A:LYS125
|
4.2
|
88.7
|
1.0
|
HH
|
A:TYR182
|
4.2
|
98.0
|
1.0
|
O3A
|
A:ATP500
|
4.3
|
84.9
|
1.0
|
OE2
|
A:GLU185
|
4.3
|
96.5
|
1.0
|
HB2
|
A:LYS125
|
4.3
|
88.7
|
1.0
|
HH21
|
B:ARG307
|
4.3
|
79.0
|
1.0
|
O1G
|
A:ATP500
|
4.3
|
84.9
|
1.0
|
CG2
|
A:THR126
|
4.4
|
90.8
|
1.0
|
OE2
|
B:GLU216
|
4.4
|
85.3
|
1.0
|
N
|
A:THR126
|
4.4
|
90.8
|
1.0
|
O1B
|
A:ATP500
|
4.4
|
84.9
|
1.0
|
PA
|
A:ATP500
|
4.4
|
84.9
|
1.0
|
NH2
|
B:ARG307
|
4.4
|
79.0
|
1.0
|
O3G
|
A:ATP500
|
4.5
|
84.9
|
1.0
|
HH21
|
A:ARG370
|
4.5
|
80.7
|
1.0
|
CA
|
A:THR126
|
4.5
|
90.8
|
1.0
|
OE1
|
B:GLU216
|
4.6
|
85.3
|
1.0
|
HH22
|
A:ARG370
|
4.7
|
80.7
|
1.0
|
HA
|
A:THR126
|
4.8
|
90.8
|
1.0
|
HG23
|
A:THR126
|
4.9
|
90.8
|
1.0
|
CD
|
B:GLU216
|
4.9
|
85.3
|
1.0
|
NH2
|
A:ARG370
|
5.0
|
80.7
|
1.0
|
OH
|
A:TYR182
|
5.0
|
98.0
|
1.0
|
HG22
|
A:THR126
|
5.0
|
90.8
|
1.0
|
|
Magnesium binding site 2 out
of 4 in 8v9r
Go back to
Magnesium Binding Sites List in 8v9r
Magnesium binding site 2 out
of 4 in the Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg501
b:70.8
occ:1.00
|
OG1
|
B:THR126
|
2.0
|
71.2
|
1.0
|
O3B
|
B:ATP500
|
2.1
|
72.2
|
1.0
|
O3A
|
B:ATP500
|
2.5
|
72.2
|
1.0
|
PB
|
B:ATP500
|
2.9
|
72.2
|
1.0
|
CB
|
B:THR126
|
3.3
|
71.2
|
1.0
|
HB
|
B:THR126
|
3.4
|
71.2
|
1.0
|
H
|
B:THR126
|
3.5
|
71.2
|
1.0
|
PG
|
B:ATP500
|
3.5
|
72.2
|
1.0
|
O3G
|
B:ATP500
|
3.6
|
72.2
|
1.0
|
O2B
|
B:ATP500
|
3.7
|
72.2
|
1.0
|
OD2
|
B:ASP184
|
3.7
|
72.9
|
1.0
|
PA
|
B:ATP500
|
3.8
|
72.2
|
1.0
|
HG21
|
B:THR126
|
4.0
|
71.2
|
1.0
|
O1A
|
B:ATP500
|
4.0
|
72.2
|
1.0
|
O1G
|
B:ATP500
|
4.0
|
72.2
|
1.0
|
HB2
|
B:LYS125
|
4.0
|
70.3
|
1.0
|
HH22
|
B:ARG370
|
4.1
|
70.8
|
1.0
|
O1B
|
B:ATP500
|
4.1
|
72.2
|
1.0
|
N
|
B:THR126
|
4.1
|
71.2
|
1.0
|
HH21
|
B:ARG370
|
4.1
|
70.8
|
1.0
|
HE2
|
B:LYS125
|
4.1
|
70.3
|
1.0
|
HH22
|
C:ARG307
|
4.1
|
68.5
|
1.0
|
CG2
|
B:THR126
|
4.2
|
71.2
|
1.0
|
HH21
|
C:ARG307
|
4.2
|
68.5
|
1.0
|
CA
|
B:THR126
|
4.3
|
71.2
|
1.0
|
OD1
|
B:ASP184
|
4.3
|
72.9
|
1.0
|
NH2
|
C:ARG307
|
4.4
|
68.5
|
1.0
|
OE1
|
C:GLU216
|
4.4
|
72.8
|
1.0
|
CG
|
B:ASP184
|
4.4
|
72.9
|
1.0
|
NH2
|
B:ARG370
|
4.4
|
70.8
|
1.0
|
OE2
|
B:GLU185
|
4.5
|
72.8
|
1.0
|
HG23
|
B:THR126
|
4.5
|
71.2
|
1.0
|
O2G
|
B:ATP500
|
4.5
|
72.2
|
1.0
|
O5'
|
B:ATP500
|
4.7
|
72.2
|
1.0
|
HA
|
B:THR126
|
4.7
|
71.2
|
1.0
|
HH
|
B:TYR182
|
4.7
|
72.5
|
1.0
|
HZ3
|
C:LYS213
|
4.8
|
72.0
|
1.0
|
O2A
|
B:ATP500
|
4.8
|
72.2
|
1.0
|
CB
|
B:LYS125
|
4.9
|
70.3
|
1.0
|
HB3
|
B:LYS125
|
5.0
|
70.3
|
1.0
|
|
Magnesium binding site 3 out
of 4 in 8v9r
Go back to
Magnesium Binding Sites List in 8v9r
Magnesium binding site 3 out
of 4 in the Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg501
b:71.9
occ:1.00
|
O2B
|
C:ATP500
|
2.0
|
70.7
|
1.0
|
OG1
|
C:THR126
|
2.0
|
68.1
|
1.0
|
O2G
|
C:ATP500
|
2.2
|
70.7
|
1.0
|
OD2
|
C:ASP184
|
3.0
|
70.5
|
1.0
|
PB
|
C:ATP500
|
3.4
|
70.7
|
1.0
|
CB
|
C:THR126
|
3.4
|
68.1
|
1.0
|
OD1
|
C:ASP184
|
3.5
|
70.5
|
1.0
|
PG
|
C:ATP500
|
3.5
|
70.7
|
1.0
|
CG
|
C:ASP184
|
3.6
|
70.5
|
1.0
|
O3B
|
C:ATP500
|
3.7
|
70.7
|
1.0
|
HG21
|
C:THR126
|
3.7
|
68.1
|
1.0
|
HB
|
C:THR126
|
3.7
|
68.1
|
1.0
|
H
|
C:THR126
|
3.9
|
68.1
|
1.0
|
OE2
|
C:GLU185
|
4.0
|
70.8
|
1.0
|
CG2
|
C:THR126
|
4.0
|
68.1
|
1.0
|
O1A
|
C:ATP500
|
4.1
|
70.7
|
1.0
|
HG23
|
C:THR126
|
4.2
|
68.1
|
1.0
|
O1G
|
C:ATP500
|
4.2
|
70.7
|
1.0
|
HH21
|
D:ARG307
|
4.2
|
72.5
|
1.0
|
HE2
|
C:LYS125
|
4.3
|
69.0
|
1.0
|
O3A
|
C:ATP500
|
4.4
|
70.7
|
1.0
|
HH22
|
D:ARG307
|
4.4
|
72.5
|
1.0
|
N
|
C:THR126
|
4.4
|
68.1
|
1.0
|
HH
|
C:TYR182
|
4.4
|
68.1
|
1.0
|
O1B
|
C:ATP500
|
4.4
|
70.7
|
1.0
|
HZ3
|
D:LYS213
|
4.4
|
74.0
|
1.0
|
CA
|
C:THR126
|
4.4
|
68.1
|
1.0
|
HB2
|
C:LYS125
|
4.4
|
69.0
|
1.0
|
HZ2
|
D:LYS213
|
4.5
|
74.0
|
1.0
|
NH2
|
D:ARG307
|
4.6
|
72.5
|
1.0
|
HH21
|
C:ARG370
|
4.6
|
72.2
|
1.0
|
HH22
|
C:ARG370
|
4.6
|
72.2
|
1.0
|
HA
|
C:THR126
|
4.6
|
68.1
|
1.0
|
OE1
|
D:GLU216
|
4.6
|
74.9
|
1.0
|
O3G
|
C:ATP500
|
4.7
|
70.7
|
1.0
|
PA
|
C:ATP500
|
4.9
|
70.7
|
1.0
|
NZ
|
D:LYS213
|
4.9
|
74.0
|
1.0
|
HG22
|
C:THR126
|
4.9
|
68.1
|
1.0
|
CD
|
C:GLU185
|
4.9
|
70.8
|
1.0
|
NH2
|
C:ARG370
|
4.9
|
72.2
|
1.0
|
HG2
|
C:GLU185
|
5.0
|
70.8
|
1.0
|
HG2
|
D:LYS213
|
5.0
|
74.0
|
1.0
|
|
Magnesium binding site 4 out
of 4 in 8v9r
Go back to
Magnesium Binding Sites List in 8v9r
Magnesium binding site 4 out
of 4 in the Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Cryo-Em Structure of A Proteolytic Clpxp Aaa+ Machine Poised to Unfold A Branched-Degron Dhfr-Ssra Substrate Bound with Mtx within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg501
b:72.7
occ:1.00
|
O2B
|
D:ADP500
|
2.0
|
80.0
|
1.0
|
HG22
|
D:THR126
|
2.1
|
76.3
|
1.0
|
HG21
|
D:THR126
|
2.6
|
76.3
|
1.0
|
HB
|
D:THR126
|
2.7
|
76.3
|
1.0
|
CG2
|
D:THR126
|
2.7
|
76.3
|
1.0
|
CB
|
D:THR126
|
3.2
|
76.3
|
1.0
|
PB
|
D:ADP500
|
3.4
|
80.0
|
1.0
|
O2A
|
D:ADP500
|
3.5
|
80.0
|
1.0
|
H
|
D:THR126
|
3.5
|
76.3
|
1.0
|
HG23
|
D:THR126
|
3.6
|
76.3
|
1.0
|
OD2
|
D:ASP184
|
3.7
|
80.4
|
1.0
|
O1B
|
D:ADP500
|
3.8
|
80.0
|
1.0
|
N
|
D:THR126
|
4.1
|
76.3
|
1.0
|
OG1
|
D:THR126
|
4.2
|
76.3
|
1.0
|
HB2
|
D:LYS125
|
4.2
|
75.3
|
1.0
|
OD1
|
D:ASP184
|
4.2
|
80.4
|
1.0
|
PA
|
D:ADP500
|
4.2
|
80.0
|
1.0
|
O3A
|
D:ADP500
|
4.2
|
80.0
|
1.0
|
CA
|
D:THR126
|
4.3
|
76.3
|
1.0
|
HE2
|
D:LYS125
|
4.3
|
75.3
|
1.0
|
CG
|
D:ASP184
|
4.3
|
80.4
|
1.0
|
O3B
|
D:ADP500
|
4.5
|
80.0
|
1.0
|
HH22
|
E:ARG307
|
4.5
|
111.1
|
1.0
|
O1A
|
D:ADP500
|
4.5
|
80.0
|
1.0
|
HH21
|
D:ARG370
|
4.6
|
97.9
|
1.0
|
OE2
|
D:GLU185
|
4.7
|
85.2
|
1.0
|
HG1
|
D:THR126
|
4.7
|
76.3
|
1.0
|
HZ3
|
E:LYS213
|
4.7
|
113.9
|
1.0
|
HA
|
D:THR126
|
4.8
|
76.3
|
1.0
|
HH
|
D:TYR182
|
4.9
|
72.6
|
1.0
|
HZ3
|
D:LYS125
|
5.0
|
75.3
|
1.0
|
|
Reference:
A.Ghanbarpour,
R.T.Sauer,
J.H.Davis.
Cryo-Em Structure of A Fully-Engaged Dhfr-Ssra Substrate and the Aaa+ Clpxp Protease To Be Published.
Page generated: Thu Oct 31 22:15:23 2024
|