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Manganese in PDB 4wce: The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus

Protein crystallography data

The structure of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus, PDB code: 4wce was solved by Z.Eyal, D.Matzov, M.Krupkin, I.Wekselman, E.Zimmerman, H.Rozenberg, A.Bashan, A.Yonath, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 49.74 / 3.53
Space group P 65 2 2
Cell size a, b, c (Å), α, β, γ (°) 279.756, 279.756, 872.725, 90.00, 90.00, 120.00
R / Rfree (%) 20.2 / 24.7

Other elements in 4wce:

The structure of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus also contains other interesting chemical elements:

Magnesium (Mg) 91 atoms

Manganese Binding Sites:

Manganese binding site 1 out of 231 in 4wce

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Manganese binding site 1 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3012

b:19.7
occ:1.00
OP2 X:A1017 3.4 19.3 1.0
OP1 X:A1017 4.0 19.6 1.0
N1 X:A866 4.1 17.8 1.0
P X:A1017 4.1 19.4 1.0
OP2 X:G613 4.2 14.0 1.0
C5 X:U611 4.2 17.0 1.0
O2' X:G1016 4.2 20.4 1.0
OP1 X:G613 4.3 14.1 1.0
N6 X:A865 4.3 17.3 1.0
C6 X:U611 4.5 17.0 1.0
C2 X:A866 4.5 18.1 1.0
OP2 X:U612 4.6 14.8 1.0
O3' X:G1016 4.7 19.7 1.0
P X:G613 4.7 13.9 1.0
N1 X:A865 4.7 17.9 1.0
C6 X:A866 4.9 17.8 1.0
C5' X:U612 4.9 14.4 1.0

Manganese binding site 2 out of 231 in 4wce

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Manganese binding site 2 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3014

b:12.3
occ:1.00
N7 X:A806 2.3 41.0 1.0
N7 X:G778 2.4 43.3 1.0
C5 X:A806 3.2 40.7 1.0
N6 X:A806 3.3 40.0 1.0
C8 X:A806 3.3 41.4 1.0
C8 X:G778 3.4 43.0 1.0
C5 X:G778 3.4 43.8 1.0
O6 X:G778 3.5 44.5 1.0
OP2 X:G778 3.6 41.6 1.0
C6 X:A806 3.7 40.2 1.0
C6 X:G778 3.8 44.4 1.0
OP2 X:A806 3.9 42.1 1.0
OP2 X:C777 4.0 53.8 1.0
C4 X:A806 4.5 40.9 1.0
N9 X:A806 4.5 41.4 1.0
N9 X:G778 4.6 43.2 1.0
C4 X:G778 4.6 43.8 1.0
C5' X:C777 4.7 53.1 1.0
C5 X:C777 4.7 55.5 1.0
OP2 X:G805 4.7 38.9 1.0
C6 X:C777 5.0 55.2 1.0
P X:G778 5.0 41.3 1.0

Manganese binding site 3 out of 231 in 4wce

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Manganese binding site 3 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 3 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3015

b:75.1
occ:1.00
O4' X:U1011 4.0 24.9 1.0
C4' X:U1011 4.4 24.7 1.0
C1' X:U1011 4.6 24.7 1.0
O2' X:A2294 4.6 25.0 1.0
O2' X:U1011 4.6 25.0 1.0
C2' X:A2294 4.7 25.2 1.0
O2' X:G1010 4.9 25.9 1.0

Manganese binding site 4 out of 231 in 4wce

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Manganese binding site 4 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 4 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3017

b:0.9
occ:1.00
OP1 X:U119 2.5 70.6 1.0
P X:U119 3.6 71.7 1.0
O5' X:U119 3.8 73.9 1.0
C5' X:U119 3.9 74.5 1.0
O3' X:A118 4.1 71.1 1.0
C3' X:A118 4.1 69.2 1.0
O6 X:G123 4.2 66.7 1.0
C4' X:A118 4.5 69.4 1.0
C5' X:A118 4.6 68.1 1.0
OP2 X:U119 5.0 71.9 1.0

Manganese binding site 5 out of 231 in 4wce

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Manganese binding site 5 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 5 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3024

b:0.5
occ:1.00
OP1 X:G2610 2.6 38.1 1.0
OP2 X:G2610 3.1 35.9 1.0
P X:G2610 3.3 37.0 1.0
N7 X:G2635 4.0 44.4 1.0
O6 X:G2635 4.0 44.2 1.0
OP2 X:U2611 4.2 44.6 1.0
O5' X:G2610 4.4 36.4 1.0
O3' X:G2609 4.4 35.9 1.0
MN X:MN3060 4.7 52.0 1.0
C6 X:G2635 4.7 44.0 1.0
C5 X:G2635 4.7 44.0 1.0
OP2 X:G2609 4.8 33.6 1.0
N7 X:G2634 5.0 29.4 1.0

Manganese binding site 6 out of 231 in 4wce

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Manganese binding site 6 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 6 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3025

b:52.3
occ:1.00
N7 X:G428 2.7 61.7 1.0
C8 X:G428 3.6 61.4 1.0
C5 X:G428 3.6 63.0 1.0
O6 X:G428 3.7 63.8 1.0
OP2 X:G432 3.8 56.3 1.0
C6 X:G428 4.0 64.0 1.0
OP2 X:G428 4.2 56.5 1.0
C5' X:G432 4.4 53.1 1.0
N7 X:A427 4.4 75.5 1.0
OP1 X:G432 4.5 54.0 1.0
P X:G432 4.5 54.5 1.0
C5 X:A427 4.7 76.5 1.0
N9 X:G428 4.8 62.4 1.0
C4 X:G428 4.8 63.5 1.0
C8 X:A427 4.8 74.5 1.0
C5 X:U433 4.9 65.9 1.0
C5 X:C429 4.9 58.8 1.0
O4 X:U433 5.0 68.9 1.0

Manganese binding site 7 out of 231 in 4wce

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Manganese binding site 7 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 7 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3040

b:74.4
occ:1.00
OP1 X:A839 2.9 31.1 1.0
OP2 X:C723 4.0 30.1 1.0
OP2 X:A722 4.2 25.6 1.0
P X:A839 4.3 31.9 1.0
OP2 X:C840 4.4 30.4 1.0
C5' X:A838 4.8 35.4 1.0
OP2 X:A839 4.9 32.6 1.0
C3' X:A838 4.9 36.7 1.0

Manganese binding site 8 out of 231 in 4wce

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Manganese binding site 8 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 8 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3041

b:85.0
occ:1.00
OP1 X:A1836 2.9 89.8 1.0
C4 X:A1836 3.9 89.6 1.0
C5 X:A1836 3.9 89.0 1.0
P X:A1836 4.0 90.4 1.0
O2' X:G1401 4.1 76.7 1.0
N3 X:A1836 4.1 89.6 1.0
O5' X:A1836 4.1 90.9 1.0
C6 X:A1836 4.2 88.2 1.0
C2 X:A1836 4.3 88.8 1.0
N9 X:A1836 4.3 90.3 1.0
O3' X:U1835 4.3 0.3 1.0
N1 X:A1836 4.3 88.1 1.0
OP1 X:U1835 4.4 0.6 1.0
N7 X:A1836 4.4 89.2 1.0
C8 X:A1836 4.6 90.0 1.0
O4' X:A1836 4.6 91.4 1.0
N6 X:A1836 4.8 87.5 1.0

Manganese binding site 9 out of 231 in 4wce

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Manganese binding site 9 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 9 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3042

b:0.0
occ:1.00
OP2 X:A150 3.1 85.6 1.0
OP2 X:U149 3.2 87.4 1.0
OP2 X:G120 3.4 81.3 1.0
P X:U149 4.0 89.4 1.0
O5' X:U149 4.2 89.5 1.0
O3' X:U119 4.3 78.2 1.0
OP1 X:U149 4.3 90.1 1.0
P X:A150 4.4 87.0 1.0
P X:G120 4.5 79.4 1.0
N7 X:A150 4.5 81.0 1.0
C8 X:A150 4.6 81.4 1.0
OP1 X:A150 4.7 87.9 1.0
C5' X:G120 4.7 81.6 1.0

Manganese binding site 10 out of 231 in 4wce

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Manganese binding site 10 out of 231 in the The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 10 of The Crystal Structure of the Large Ribosomal Subunit of Staphylococcus Aureus within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Mn3043

b:61.0
occ:1.00
O4 X:U477 2.5 63.6 1.0
OP2 X:A476 2.8 66.5 1.0
OP1 X:A476 3.5 65.4 1.0
C4 X:U477 3.5 62.8 1.0
P X:A476 3.6 66.4 1.0
O5' X:A219 3.8 66.8 1.0
C5 X:U477 4.0 62.5 1.0
OP1 X:A475 4.1 70.8 1.0
C5' X:A219 4.3 67.4 1.0
C8 X:A219 4.4 62.6 1.0
O5' X:A475 4.4 71.0 1.0
OP2 X:A475 4.5 70.8 1.0
P X:A475 4.5 71.4 1.0
O3' X:A475 4.6 68.3 1.0
N3 X:U477 4.8 62.2 1.0
N7 X:A219 4.8 61.6 1.0
OP2 X:A219 4.8 67.2 1.0
O5' X:A476 4.9 65.6 1.0

Reference:

Z.Eyal, D.Matzov, M.Krupkin, I.Wekselman, S.Paukner, E.Zimmerman, H.Rozenberg, A.Bashan, A.Yonath. Structural Insights Into Species-Specific Features of the Ribosome From the Pathogen Staphylococcus Aureus. Proc.Natl.Acad.Sci.Usa V. 112 E5805 2015.
ISSN: ESSN 1091-6490
PubMed: 26464510
DOI: 10.1073/PNAS.1517952112
Page generated: Tue Dec 15 04:30:34 2020

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