Magnesium in PDB 7qsw: L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos
Enzymatic activity of L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos
All present enzymatic activity of L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos:
4.1.1.39;
Protein crystallography data
The structure of L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos, PDB code: 7qsw
was solved by
J.Zarzycki,
L.Schulz,
T.J.Erb,
G.K.A.Hochberg,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
19.96 /
1.80
|
Space group
|
P 43 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
131.873,
131.873,
305.463,
90,
90,
90
|
R / Rfree (%)
|
14.1 /
15.9
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos
(pdb code 7qsw). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the
L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos, PDB code: 7qsw:
Jump to Magnesium binding site number:
1;
2;
3;
4;
Magnesium binding site 1 out
of 4 in 7qsw
Go back to
Magnesium Binding Sites List in 7qsw
Magnesium binding site 1 out
of 4 in the L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg502
b:17.5
occ:1.00
|
OQ2
|
A:KCX199
|
2.0
|
18.1
|
1.0
|
OD1
|
A:ASP201
|
2.0
|
17.4
|
1.0
|
OE1
|
A:GLU202
|
2.0
|
18.8
|
1.0
|
O7
|
A:CAP501
|
2.1
|
16.8
|
1.0
|
O3
|
A:CAP501
|
2.2
|
16.2
|
1.0
|
O2
|
A:CAP501
|
2.2
|
18.1
|
1.0
|
C2
|
A:CAP501
|
2.8
|
17.8
|
1.0
|
C
|
A:CAP501
|
2.8
|
17.4
|
1.0
|
CX
|
A:KCX199
|
3.0
|
16.1
|
1.0
|
C3
|
A:CAP501
|
3.0
|
16.7
|
1.0
|
CD
|
A:GLU202
|
3.1
|
17.6
|
1.0
|
CG
|
A:ASP201
|
3.2
|
16.4
|
1.0
|
OQ1
|
A:KCX199
|
3.4
|
17.9
|
1.0
|
OE2
|
A:GLU202
|
3.5
|
19.2
|
1.0
|
NZ
|
A:LYS175
|
3.7
|
18.3
|
1.0
|
N
|
A:GLU202
|
3.8
|
15.7
|
1.0
|
OD2
|
A:ASP201
|
3.9
|
17.9
|
1.0
|
CG2
|
A:THR171
|
3.9
|
16.7
|
1.0
|
NZ
|
A:LYS173
|
4.0
|
16.4
|
1.0
|
NE2
|
A:HIS292
|
4.0
|
16.6
|
1.0
|
O6
|
A:CAP501
|
4.0
|
16.1
|
1.0
|
NZ
|
A:KCX199
|
4.2
|
16.0
|
1.0
|
CA
|
A:ASP201
|
4.2
|
16.1
|
1.0
|
C4
|
A:CAP501
|
4.2
|
18.0
|
1.0
|
C1
|
A:CAP501
|
4.3
|
17.1
|
1.0
|
CB
|
A:ASP201
|
4.3
|
16.3
|
1.0
|
CG
|
A:GLU202
|
4.3
|
15.9
|
1.0
|
OG1
|
A:THR171
|
4.3
|
17.5
|
1.0
|
CB
|
A:GLU202
|
4.5
|
15.0
|
1.0
|
C
|
A:ASP201
|
4.6
|
16.9
|
1.0
|
CD2
|
A:HIS292
|
4.6
|
15.6
|
1.0
|
CB
|
A:THR171
|
4.7
|
18.2
|
1.0
|
C5
|
A:CAP501
|
4.7
|
15.4
|
1.0
|
O1
|
A:CAP501
|
4.7
|
18.2
|
1.0
|
CA
|
A:GLU202
|
4.8
|
15.5
|
1.0
|
CE1
|
A:HIS292
|
4.9
|
15.8
|
1.0
|
|
Magnesium binding site 2 out
of 4 in 7qsw
Go back to
Magnesium Binding Sites List in 7qsw
Magnesium binding site 2 out
of 4 in the L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg502
b:16.6
occ:1.00
|
OD1
|
C:ASP201
|
2.0
|
16.1
|
1.0
|
OQ1
|
C:KCX199
|
2.0
|
15.6
|
1.0
|
OE1
|
C:GLU202
|
2.0
|
14.8
|
1.0
|
O6
|
C:CAP501
|
2.1
|
16.7
|
1.0
|
O3
|
C:CAP501
|
2.2
|
16.9
|
1.0
|
O2
|
C:CAP501
|
2.3
|
16.1
|
1.0
|
C2
|
C:CAP501
|
2.8
|
16.9
|
1.0
|
C
|
C:CAP501
|
2.8
|
18.1
|
1.0
|
CX
|
C:KCX199
|
3.0
|
16.6
|
1.0
|
C3
|
C:CAP501
|
3.0
|
15.5
|
1.0
|
CD
|
C:GLU202
|
3.1
|
15.5
|
1.0
|
CG
|
C:ASP201
|
3.2
|
18.2
|
1.0
|
OQ2
|
C:KCX199
|
3.4
|
15.9
|
1.0
|
OE2
|
C:GLU202
|
3.5
|
17.1
|
1.0
|
NZ
|
C:LYS175
|
3.7
|
16.7
|
1.0
|
N
|
C:GLU202
|
3.8
|
16.5
|
1.0
|
OD2
|
C:ASP201
|
3.9
|
17.2
|
1.0
|
CG2
|
C:THR171
|
3.9
|
15.4
|
1.0
|
NZ
|
C:LYS173
|
3.9
|
15.3
|
1.0
|
NE2
|
C:HIS292
|
4.0
|
15.9
|
1.0
|
O7
|
C:CAP501
|
4.0
|
18.3
|
1.0
|
CA
|
C:ASP201
|
4.2
|
16.0
|
1.0
|
NZ
|
C:KCX199
|
4.2
|
15.5
|
1.0
|
CB
|
C:ASP201
|
4.2
|
14.6
|
1.0
|
C4
|
C:CAP501
|
4.3
|
17.6
|
1.0
|
OG1
|
C:THR171
|
4.3
|
17.3
|
1.0
|
C1
|
C:CAP501
|
4.3
|
17.5
|
1.0
|
CG
|
C:GLU202
|
4.3
|
15.9
|
1.0
|
CB
|
C:GLU202
|
4.5
|
15.5
|
1.0
|
C
|
C:ASP201
|
4.5
|
15.4
|
1.0
|
CD2
|
C:HIS292
|
4.6
|
14.8
|
1.0
|
CB
|
C:THR171
|
4.6
|
16.6
|
1.0
|
C5
|
C:CAP501
|
4.7
|
15.4
|
1.0
|
O1
|
C:CAP501
|
4.8
|
17.1
|
1.0
|
CA
|
C:GLU202
|
4.8
|
14.7
|
1.0
|
CE1
|
C:HIS292
|
4.9
|
14.4
|
1.0
|
|
Magnesium binding site 3 out
of 4 in 7qsw
Go back to
Magnesium Binding Sites List in 7qsw
Magnesium binding site 3 out
of 4 in the L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg502
b:20.3
occ:1.00
|
OD1
|
E:ASP201
|
2.0
|
21.2
|
1.0
|
OQ2
|
E:KCX199
|
2.0
|
18.2
|
1.0
|
OE1
|
E:GLU202
|
2.0
|
19.9
|
1.0
|
O7
|
E:CAP501
|
2.1
|
20.2
|
1.0
|
O3
|
E:CAP501
|
2.2
|
21.6
|
1.0
|
O2
|
E:CAP501
|
2.2
|
20.9
|
1.0
|
C2
|
E:CAP501
|
2.8
|
21.2
|
1.0
|
C
|
E:CAP501
|
2.8
|
20.6
|
1.0
|
CX
|
E:KCX199
|
3.0
|
19.2
|
1.0
|
C3
|
E:CAP501
|
3.0
|
18.0
|
1.0
|
CD
|
E:GLU202
|
3.1
|
20.3
|
1.0
|
CG
|
E:ASP201
|
3.2
|
19.6
|
1.0
|
OQ1
|
E:KCX199
|
3.3
|
19.6
|
1.0
|
OE2
|
E:GLU202
|
3.6
|
22.0
|
1.0
|
NZ
|
E:LYS175
|
3.7
|
20.7
|
1.0
|
N
|
E:GLU202
|
3.8
|
20.0
|
1.0
|
OD2
|
E:ASP201
|
3.9
|
19.9
|
1.0
|
CG2
|
E:THR171
|
3.9
|
19.1
|
1.0
|
NZ
|
E:LYS173
|
3.9
|
19.5
|
1.0
|
NE2
|
E:HIS292
|
4.0
|
19.3
|
1.0
|
O6
|
E:CAP501
|
4.1
|
21.1
|
1.0
|
CA
|
E:ASP201
|
4.2
|
18.4
|
1.0
|
NZ
|
E:KCX199
|
4.2
|
17.6
|
1.0
|
CB
|
E:ASP201
|
4.3
|
17.5
|
1.0
|
C4
|
E:CAP501
|
4.3
|
21.1
|
1.0
|
OG1
|
E:THR171
|
4.3
|
20.1
|
1.0
|
CG
|
E:GLU202
|
4.3
|
19.0
|
1.0
|
C1
|
E:CAP501
|
4.3
|
19.5
|
1.0
|
CB
|
E:GLU202
|
4.5
|
19.6
|
1.0
|
C
|
E:ASP201
|
4.5
|
18.4
|
1.0
|
CD2
|
E:HIS292
|
4.6
|
18.0
|
1.0
|
CB
|
E:THR171
|
4.7
|
20.7
|
1.0
|
CA
|
E:GLU202
|
4.7
|
17.3
|
1.0
|
O1
|
E:CAP501
|
4.7
|
21.1
|
1.0
|
C5
|
E:CAP501
|
4.8
|
20.6
|
1.0
|
CE1
|
E:HIS292
|
4.9
|
20.6
|
1.0
|
|
Magnesium binding site 4 out
of 4 in 7qsw
Go back to
Magnesium Binding Sites List in 7qsw
Magnesium binding site 4 out
of 4 in the L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of L8S8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Ssu-Bearing Form I Rubiscos within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Mg502
b:17.4
occ:1.00
|
OE1
|
G:GLU202
|
2.0
|
17.2
|
1.0
|
OD1
|
G:ASP201
|
2.0
|
17.1
|
1.0
|
OQ1
|
G:KCX199
|
2.1
|
16.8
|
1.0
|
O6
|
G:CAP501
|
2.1
|
17.2
|
1.0
|
O3
|
G:CAP501
|
2.2
|
17.2
|
1.0
|
O2
|
G:CAP501
|
2.2
|
19.2
|
1.0
|
C2
|
G:CAP501
|
2.8
|
17.4
|
1.0
|
C
|
G:CAP501
|
2.8
|
19.6
|
1.0
|
CX
|
G:KCX199
|
3.0
|
18.7
|
1.0
|
CD
|
G:GLU202
|
3.0
|
16.9
|
1.0
|
C3
|
G:CAP501
|
3.0
|
17.9
|
1.0
|
CG
|
G:ASP201
|
3.2
|
18.7
|
1.0
|
OQ2
|
G:KCX199
|
3.4
|
18.3
|
1.0
|
OE2
|
G:GLU202
|
3.5
|
18.7
|
1.0
|
NZ
|
G:LYS175
|
3.7
|
17.0
|
1.0
|
N
|
G:GLU202
|
3.8
|
14.8
|
1.0
|
OD2
|
G:ASP201
|
3.9
|
18.2
|
1.0
|
NZ
|
G:LYS173
|
3.9
|
18.5
|
1.0
|
CG2
|
G:THR171
|
4.0
|
16.7
|
1.0
|
NE2
|
G:HIS292
|
4.0
|
17.7
|
1.0
|
O7
|
G:CAP501
|
4.0
|
18.4
|
1.0
|
CA
|
G:ASP201
|
4.2
|
16.1
|
1.0
|
NZ
|
G:KCX199
|
4.3
|
16.1
|
1.0
|
C4
|
G:CAP501
|
4.3
|
18.6
|
1.0
|
CB
|
G:ASP201
|
4.3
|
17.2
|
1.0
|
CG
|
G:GLU202
|
4.3
|
16.1
|
1.0
|
C1
|
G:CAP501
|
4.3
|
17.4
|
1.0
|
OG1
|
G:THR171
|
4.3
|
17.5
|
1.0
|
CB
|
G:GLU202
|
4.5
|
17.6
|
1.0
|
C
|
G:ASP201
|
4.6
|
16.8
|
1.0
|
CD2
|
G:HIS292
|
4.7
|
15.4
|
1.0
|
CB
|
G:THR171
|
4.7
|
18.4
|
1.0
|
C5
|
G:CAP501
|
4.7
|
18.6
|
1.0
|
O1
|
G:CAP501
|
4.7
|
18.4
|
1.0
|
CA
|
G:GLU202
|
4.8
|
16.4
|
1.0
|
CE1
|
G:HIS292
|
4.9
|
15.9
|
1.0
|
|
Reference:
L.Schulz,
Z.Guo,
J.Zarzycki,
W.Steinchen,
J.M.Schuller,
T.Heimerl,
S.Prinz,
O.Mueller-Cajar,
T.J.Erb,
G.K.A.Hochberg.
Evolution of Increased Complexity and Specificity at the Dawn of Form I Rubiscos. Science V. 378 155 2022.
ISSN: ESSN 1095-9203
PubMed: 36227987
DOI: 10.1126/SCIENCE.ABQ1416
Page generated: Thu Oct 3 06:45:12 2024
|