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Magnesium in PDB 7qsv: L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos

Enzymatic activity of L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos

All present enzymatic activity of L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos:
4.1.1.39;

Protein crystallography data

The structure of L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos, PDB code: 7qsv 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) 29.86 / 2.10
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 114.007, 203.445, 174.974, 90, 100.43, 90
R / Rfree (%) 18.9 / 22.3

Magnesium Binding Sites:

The binding sites of Magnesium atom in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos (pdb code 7qsv). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 8 binding sites of Magnesium where determined in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos, PDB code: 7qsv:
Jump to Magnesium binding site number: 1; 2; 3; 4; 5; 6; 7; 8;

Magnesium binding site 1 out of 8 in 7qsv

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Magnesium binding site 1 out of 8 in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and 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 L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg502

b:27.5
occ:1.00
OD1 A:ASP189 1.9 27.0 1.0
OQ1 A:KCX187 2.0 25.7 1.0
O6 A:CAP501 2.1 28.7 1.0
OE1 A:GLU190 2.1 26.5 1.0
O3 A:CAP501 2.2 27.2 1.0
O2 A:CAP501 2.2 29.6 1.0
C2 A:CAP501 2.8 26.5 1.0
C A:CAP501 2.8 27.3 1.0
C3 A:CAP501 3.0 26.4 1.0
CX A:KCX187 3.0 28.4 1.0
CD A:GLU190 3.1 26.9 1.0
CG A:ASP189 3.1 26.4 1.0
OQ2 A:KCX187 3.4 27.7 1.0
OE2 A:GLU190 3.5 26.9 1.0
NZ A:LYS163 3.9 26.3 1.0
N A:GLU190 3.9 24.7 1.0
NZ A:LYS161 3.9 26.3 1.0
OD2 A:ASP189 3.9 27.8 1.0
CG2 A:THR159 4.0 25.8 1.0
O7 A:CAP501 4.0 27.7 1.0
CA A:ASP189 4.1 25.9 1.0
CB A:ASP189 4.1 26.3 1.0
NE2 A:HIS280 4.2 26.3 1.0
NZ A:KCX187 4.2 28.1 1.0
C4 A:CAP501 4.2 26.4 1.0
C1 A:CAP501 4.3 26.5 1.0
OG1 A:THR159 4.3 27.1 1.0
CG A:GLU190 4.4 24.4 1.0
C A:ASP189 4.5 24.1 1.0
CB A:GLU190 4.7 25.9 1.0
O1 A:CAP501 4.7 28.4 1.0
CB A:THR159 4.7 26.1 1.0
CD2 A:HIS280 4.8 25.3 1.0
C5 A:CAP501 4.8 26.2 1.0
CA A:GLU190 4.9 25.5 1.0
O A:HOH2070 4.9 27.9 1.0

Magnesium binding site 2 out of 8 in 7qsv

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Magnesium binding site 2 out of 8 in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and 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 L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg502

b:23.0
occ:1.00
OD1 B:ASP189 2.0 24.5 1.0
OQ1 B:KCX187 2.0 22.5 1.0
O6 B:CAP501 2.1 23.6 1.0
OE1 B:GLU190 2.1 22.1 1.0
O3 B:CAP501 2.2 23.6 1.0
O2 B:CAP501 2.2 25.4 1.0
C2 B:CAP501 2.8 25.1 1.0
C B:CAP501 2.8 24.9 1.0
C3 B:CAP501 3.0 23.5 1.0
CX B:KCX187 3.0 23.2 1.0
CD B:GLU190 3.1 21.4 1.0
CG B:ASP189 3.2 23.1 1.0
OQ2 B:KCX187 3.4 23.8 1.0
OE2 B:GLU190 3.6 21.8 1.0
NZ B:LYS161 3.7 24.6 1.0
N B:GLU190 3.9 20.1 1.0
CG2 B:THR159 3.9 21.2 1.0
OD2 B:ASP189 3.9 24.8 1.0
NZ B:LYS163 3.9 21.9 1.0
O7 B:CAP501 4.0 23.8 1.0
CA B:ASP189 4.1 21.2 1.0
CB B:ASP189 4.2 20.5 1.0
NE2 B:HIS280 4.2 19.9 1.0
NZ B:KCX187 4.2 21.6 1.0
OG1 B:THR159 4.2 22.9 1.0
C1 B:CAP501 4.2 25.4 1.0
C4 B:CAP501 4.3 23.0 1.0
CG B:GLU190 4.4 19.1 1.0
C B:ASP189 4.6 21.7 1.0
CB B:THR159 4.6 20.2 1.0
O1 B:CAP501 4.6 23.8 1.0
CB B:GLU190 4.7 19.1 1.0
C5 B:CAP501 4.8 22.0 1.0
CD2 B:HIS280 4.8 21.0 1.0
CA B:GLU190 4.9 20.9 1.0

Magnesium binding site 3 out of 8 in 7qsv

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Magnesium binding site 3 out of 8 in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and 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 L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Mg502

b:23.1
occ:1.00
OD1 C:ASP189 2.0 22.7 1.0
OQ1 C:KCX187 2.0 22.5 1.0
OE1 C:GLU190 2.0 23.5 1.0
O6 C:CAP501 2.1 23.3 1.0
O3 C:CAP501 2.3 22.3 1.0
O2 C:CAP501 2.3 20.4 1.0
C C:CAP501 2.9 20.7 1.0
C2 C:CAP501 2.9 22.0 1.0
CX C:KCX187 3.0 23.0 1.0
CD C:GLU190 3.1 22.4 1.0
C3 C:CAP501 3.1 21.0 1.0
CG C:ASP189 3.2 22.0 1.0
OQ2 C:KCX187 3.4 25.0 1.0
OE2 C:GLU190 3.6 22.0 1.0
NZ C:LYS163 3.7 21.1 1.0
N C:GLU190 3.7 21.2 1.0
NZ C:LYS161 3.9 20.9 1.0
CG2 C:THR159 3.9 20.8 1.0
CA C:ASP189 4.0 22.1 1.0
OD2 C:ASP189 4.0 24.0 1.0
CB C:ASP189 4.1 19.7 1.0
O7 C:CAP501 4.1 20.9 1.0
NE2 C:HIS280 4.1 21.4 1.0
NZ C:KCX187 4.2 22.7 1.0
CG C:GLU190 4.3 18.6 1.0
OG1 C:THR159 4.3 21.1 1.0
C4 C:CAP501 4.4 23.5 1.0
C1 C:CAP501 4.4 21.2 1.0
C C:ASP189 4.4 21.5 1.0
CB C:GLU190 4.5 20.2 1.0
CB C:THR159 4.7 22.0 1.0
CA C:GLU190 4.7 19.7 1.0
O1 C:CAP501 4.7 22.8 1.0
CD2 C:HIS280 4.7 20.6 1.0
C5 C:CAP501 4.8 20.1 1.0
CE1 C:HIS280 5.0 18.9 1.0

Magnesium binding site 4 out of 8 in 7qsv

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Magnesium binding site 4 out of 8 in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and 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 L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Mg502

b:25.4
occ:1.00
OD1 D:ASP189 2.0 24.9 1.0
O6 D:CAP501 2.0 25.4 1.0
OQ2 D:KCX187 2.1 27.0 1.0
OE1 D:GLU190 2.1 25.1 1.0
O2 D:CAP501 2.2 26.1 1.0
O3 D:CAP501 2.3 24.9 1.0
C D:CAP501 2.8 25.5 1.0
C2 D:CAP501 2.8 26.3 1.0
CX D:KCX187 3.0 27.3 1.0
C3 D:CAP501 3.1 25.9 1.0
CG D:ASP189 3.1 24.8 1.0
CD D:GLU190 3.2 24.8 1.0
OQ1 D:KCX187 3.4 28.4 1.0
OE2 D:GLU190 3.6 26.4 1.0
NZ D:LYS163 3.7 26.9 1.0
N D:GLU190 3.8 25.6 1.0
NZ D:LYS161 3.9 25.2 1.0
OD2 D:ASP189 3.9 27.0 1.0
CG2 D:THR159 3.9 24.6 1.0
O7 D:CAP501 4.0 25.6 1.0
CA D:ASP189 4.0 24.6 1.0
CB D:ASP189 4.1 23.8 1.0
NE2 D:HIS280 4.2 23.7 1.0
OG1 D:THR159 4.2 26.3 1.0
NZ D:KCX187 4.2 27.0 1.0
C1 D:CAP501 4.3 25.5 1.0
C4 D:CAP501 4.3 24.6 1.0
CG D:GLU190 4.5 23.1 1.0
C D:ASP189 4.5 25.9 1.0
CB D:THR159 4.6 25.5 1.0
O1 D:CAP501 4.6 24.7 1.0
CB D:GLU190 4.7 23.3 1.0
CD2 D:HIS280 4.7 25.1 1.0
CA D:GLU190 4.9 23.4 1.0
C5 D:CAP501 4.9 25.4 1.0

Magnesium binding site 5 out of 8 in 7qsv

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Magnesium binding site 5 out of 8 in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 5 of L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Mg502

b:30.3
occ:1.00
OD1 E:ASP189 2.0 28.7 1.0
OQ1 E:KCX187 2.0 28.9 1.0
O6 E:CAP501 2.1 31.9 1.0
OE1 E:GLU190 2.1 29.5 1.0
O3 E:CAP501 2.2 30.9 1.0
O2 E:CAP501 2.2 29.5 1.0
C2 E:CAP501 2.8 30.6 1.0
C E:CAP501 2.8 32.0 1.0
C3 E:CAP501 3.0 29.6 1.0
CX E:KCX187 3.0 31.3 1.0
CG E:ASP189 3.2 30.8 1.0
CD E:GLU190 3.2 30.8 1.0
OQ2 E:KCX187 3.4 32.5 1.0
OE2 E:GLU190 3.7 31.0 1.0
N E:GLU190 3.8 29.1 1.0
NZ E:LYS161 3.9 32.9 1.0
OD2 E:ASP189 3.9 32.0 1.0
NZ E:LYS163 3.9 31.1 1.0
CG2 E:THR159 4.0 30.4 1.0
O7 E:CAP501 4.0 33.0 1.0
CA E:ASP189 4.0 28.9 1.0
CB E:ASP189 4.1 30.0 1.0
NE2 E:HIS280 4.1 29.3 1.0
NZ E:KCX187 4.2 28.4 1.0
C4 E:CAP501 4.3 31.9 1.0
C1 E:CAP501 4.3 31.0 1.0
OG1 E:THR159 4.3 30.6 1.0
CG E:GLU190 4.4 29.8 1.0
C E:ASP189 4.5 29.9 1.0
CB E:GLU190 4.6 27.3 1.0
CB E:THR159 4.7 28.9 1.0
O1 E:CAP501 4.7 31.0 1.0
CD2 E:HIS280 4.7 29.3 1.0
C5 E:CAP501 4.8 30.5 1.0
CA E:GLU190 4.8 28.7 1.0

Magnesium binding site 6 out of 8 in 7qsv

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Magnesium binding site 6 out of 8 in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 6 of L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Mg502

b:26.2
occ:1.00
OD1 F:ASP189 1.9 24.7 1.0
O6 F:CAP501 2.1 25.5 1.0
OQ1 F:KCX187 2.1 24.6 1.0
OE1 F:GLU190 2.1 26.1 1.0
O3 F:CAP501 2.2 26.4 1.0
O2 F:CAP501 2.2 28.6 1.0
C2 F:CAP501 2.8 25.6 1.0
C F:CAP501 2.8 24.2 1.0
C3 F:CAP501 3.0 26.2 1.0
CX F:KCX187 3.1 27.4 1.0
CG F:ASP189 3.1 25.5 1.0
CD F:GLU190 3.2 25.2 1.0
OQ2 F:KCX187 3.4 28.2 1.0
OE2 F:GLU190 3.7 24.2 1.0
NZ F:LYS161 3.8 26.6 1.0
NZ F:LYS163 3.8 25.8 1.0
N F:GLU190 3.8 22.5 1.0
CG2 F:THR159 3.9 24.7 1.0
OD2 F:ASP189 3.9 26.4 1.0
O7 F:CAP501 4.0 25.6 1.0
CA F:ASP189 4.0 24.9 1.0
CB F:ASP189 4.1 25.4 1.0
NE2 F:HIS280 4.1 24.0 1.0
OG1 F:THR159 4.2 24.4 1.0
NZ F:KCX187 4.3 24.7 1.0
C4 F:CAP501 4.3 24.1 1.0
C1 F:CAP501 4.3 25.6 1.0
CG F:GLU190 4.5 24.1 1.0
C F:ASP189 4.5 25.7 1.0
CB F:THR159 4.6 25.2 1.0
CB F:GLU190 4.7 23.9 1.0
O1 F:CAP501 4.7 27.2 1.0
CD2 F:HIS280 4.7 24.4 1.0
C5 F:CAP501 4.8 24.4 1.0
CA F:GLU190 4.9 24.7 1.0

Magnesium binding site 7 out of 8 in 7qsv

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Magnesium binding site 7 out of 8 in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 7 of L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Mg502

b:27.2
occ:1.00
O6 G:CAP501 2.0 27.4 1.0
OD1 G:ASP189 2.0 27.2 1.0
OQ1 G:KCX187 2.1 26.9 1.0
OE1 G:GLU190 2.1 27.2 1.0
O2 G:CAP501 2.3 27.1 1.0
O3 G:CAP501 2.3 27.1 1.0
C G:CAP501 2.8 27.4 1.0
C2 G:CAP501 2.9 27.2 1.0
CX G:KCX187 3.1 26.7 1.0
C3 G:CAP501 3.1 28.5 1.0
CG G:ASP189 3.1 27.2 1.0
CD G:GLU190 3.2 27.3 1.0
OQ2 G:KCX187 3.5 27.9 1.0
OE2 G:GLU190 3.6 27.5 1.0
NZ G:LYS163 3.6 27.7 1.0
N G:GLU190 3.8 26.9 1.0
NZ G:LYS161 3.9 27.4 1.0
OD2 G:ASP189 3.9 27.3 1.0
CG2 G:THR159 3.9 26.9 1.0
O7 G:CAP501 4.0 27.6 1.0
CA G:ASP189 4.0 26.9 1.0
CB G:ASP189 4.0 27.1 1.0
NE2 G:HIS280 4.2 26.9 1.0
NZ G:KCX187 4.2 26.5 1.0
OG1 G:THR159 4.3 26.8 1.0
C1 G:CAP501 4.3 27.3 1.0
C4 G:CAP501 4.4 27.2 1.0
CG G:GLU190 4.4 27.2 1.0
C G:ASP189 4.5 26.9 1.0
CB G:GLU190 4.6 27.0 1.0
CB G:THR159 4.7 26.9 1.0
O1 G:CAP501 4.7 27.4 1.0
CD2 G:HIS280 4.8 26.7 1.0
CA G:GLU190 4.8 26.9 1.0
C5 G:CAP501 4.9 27.1 1.0
CE G:LYS163 5.0 27.8 1.0

Magnesium binding site 8 out of 8 in 7qsv

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Magnesium binding site 8 out of 8 in the L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 8 of L8-Complex Forming Rubisco Derived From Ancestral Sequence Reconstruction of the Last Common Ancestor of Form I'' and Form I Rubiscos within 5.0Å range:
probe atom residue distance (Å) B Occ
H:Mg502

b:30.5
occ:1.00
OE1 H:GLU190 2.0 29.0 1.0
OD1 H:ASP189 2.0 28.4 1.0
OQ1 H:KCX187 2.1 29.1 1.0
O6 H:CAP501 2.1 32.9 1.0
O3 H:CAP501 2.2 30.1 1.0
O2 H:CAP501 2.4 30.1 1.0
C2 H:CAP501 2.9 31.7 1.0
C H:CAP501 2.9 30.0 1.0
CD H:GLU190 3.0 30.2 1.0
CX H:KCX187 3.0 29.5 1.0
C3 H:CAP501 3.0 30.8 1.0
CG H:ASP189 3.2 28.9 1.0
OQ2 H:KCX187 3.3 29.3 1.0
OE2 H:GLU190 3.4 31.8 1.0
N H:GLU190 3.7 28.1 1.0
NZ H:LYS163 3.8 28.8 1.0
NE2 H:HIS280 4.0 29.4 1.0
CA H:ASP189 4.0 27.9 1.0
NZ H:LYS161 4.0 28.6 1.0
OD2 H:ASP189 4.0 30.0 1.0
CB H:ASP189 4.1 28.0 1.0
O7 H:CAP501 4.1 29.2 1.0
CG2 H:THR159 4.1 29.3 1.0
NZ H:KCX187 4.2 28.2 1.0
CG H:GLU190 4.3 28.8 1.0
C4 H:CAP501 4.3 29.6 1.0
C1 H:CAP501 4.4 29.0 1.0
C H:ASP189 4.4 27.9 1.0
OG1 H:THR159 4.4 29.1 1.0
CB H:GLU190 4.5 28.3 1.0
CD2 H:HIS280 4.5 28.4 1.0
CA H:GLU190 4.7 28.1 1.0
C5 H:CAP501 4.7 29.1 1.0
O1 H:CAP501 4.8 30.7 1.0
CB H:THR159 4.8 29.9 1.0
CE1 H:HIS280 4.9 29.7 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 06:43:34 2024

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