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Magnesium in PDB 4dv2: Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A

Protein crystallography data

The structure of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A, PDB code: 4dv2 was solved by H.Demirci, F.Murphy Iv, E.Murphy, S.T.Gregory, A.E.Dahlberg, G.Jogl, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 29.77 / 3.65
Space group P 41 21 2
Cell size a, b, c (Å), α, β, γ (°) 403.743, 403.743, 173.221, 90.00, 90.00, 90.00
R / Rfree (%) 16.5 / 22.3

Other elements in 4dv2:

The structure of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A also contains other interesting chemical elements:

Zinc (Zn) 2 atoms

Magnesium Binding Sites:

Magnesium binding site 1 out of 289 in 4dv2

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Magnesium binding site 1 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1601

b:0.1
occ:1.00
O4 A:U65 3.3 0.1 1.0
O2 A:C381 3.7 0.5 1.0
C4 A:U65 4.5 0.2 1.0
C2 A:C381 4.6 0.2 1.0
N3 A:C381 4.6 1.0 1.0

Magnesium binding site 2 out of 289 in 4dv2

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Magnesium binding site 2 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1602

b:0.4
occ:1.00
O A:HOH1903 2.1 86.3 1.0
O A:HOH1902 2.1 0.2 1.0
O A:HOH1901 2.1 79.0 1.0
O6 A:G377 3.7 0.2 1.0
N7 A:G376 3.8 0.4 1.0
N7 A:G377 4.2 0.6 1.0
MG A:MG1781 4.4 0.6 1.0
C5 A:G376 4.4 0.0 1.0
C8 A:G376 4.5 0.9 1.0
C6 A:G377 4.5 0.7 1.0
O6 A:G376 4.5 1.0 1.0
C5 A:G377 4.7 0.3 1.0
C6 A:G376 4.8 0.6 1.0

Magnesium binding site 3 out of 289 in 4dv2

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Magnesium binding site 3 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 3 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1603

b:0.6
occ:1.00
O A:HOH1906 2.1 0.4 1.0
O A:HOH1905 2.1 0.9 1.0
O A:HOH1904 2.1 0.9 1.0
N7 A:G650 3.8 0.2 1.0
O6 A:G650 3.8 0.1 1.0
O6 A:G649 3.9 0.3 1.0
N7 A:G649 4.2 0.5 1.0
OP2 A:A753 4.4 0.9 1.0
C6 A:G649 4.4 0.7 1.0
C5 A:G649 4.5 0.7 1.0
C5 A:G650 4.6 0.8 1.0
C6 A:G650 4.6 0.7 1.0
C8 A:G650 4.9 0.8 1.0

Magnesium binding site 4 out of 289 in 4dv2

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Magnesium binding site 4 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 4 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1604

b:0.7
occ:1.00
O A:HOH1907 2.1 0.6 1.0
O A:HOH1908 2.1 82.3 1.0
OP2 A:C749 3.0 1.0 1.0
OP2 A:G750 3.5 0.4 1.0
OP2 A:A653 3.9 0.6 1.0
P A:C749 4.2 0.1 1.0
O2' A:C748 4.3 0.7 1.0
OP1 A:C749 4.4 0.6 1.0
O6 A:G752 4.4 0.1 1.0
N7 A:G750 4.7 0.6 1.0
O2' A:U652 5.0 96.4 1.0
P A:G750 5.0 0.8 1.0

Magnesium binding site 5 out of 289 in 4dv2

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Magnesium binding site 5 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 5 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1605

b:0.9
occ:1.00
O A:HOH2114 2.7 0.5 1.0
O6 A:G741 3.1 0.3 1.0
O A:HOH2115 3.1 0.5 1.0
O6 A:G742 3.2 0.5 1.0
N7 A:G741 3.5 0.0 1.0
O6 A:G664 3.6 0.0 1.0
C6 A:G741 3.8 0.8 1.0
C6 A:G742 4.0 0.6 1.0
N7 A:G742 4.0 1.0 1.0
MG A:MG1785 4.0 0.5 1.0
C5 A:G741 4.0 0.4 1.0
C5 A:G742 4.3 0.6 1.0
C8 A:G741 4.6 0.0 1.0
C6 A:G664 4.7 0.5 1.0
O A:HOH2116 4.8 0.1 1.0
N1 A:G664 4.9 0.0 1.0
N6 A:A663 4.9 0.9 1.0

Magnesium binding site 6 out of 289 in 4dv2

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Magnesium binding site 6 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 6 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1606

b:0.8
occ:1.00
O A:HOH1912 2.1 77.5 1.0
O A:HOH1910 2.1 0.4 1.0
O A:HOH1909 2.1 68.1 1.0
O A:HOH1911 2.1 92.0 1.0
OP2 A:G117 2.3 0.4 1.0
OP2 A:G289 2.6 0.6 1.0
P A:G117 3.6 0.6 1.0
OP2 A:A116 3.7 0.7 1.0
OP1 A:A116 3.7 0.3 1.0
P A:G289 3.7 0.4 1.0
O4 A:U118 3.8 0.8 1.0
O3' A:A116 4.0 0.2 1.0
O5' A:A288 4.0 0.1 1.0
C3' A:A288 4.1 93.2 1.0
OP1 A:G289 4.1 0.4 1.0
P A:A116 4.2 0.9 1.0
O3' A:A288 4.4 87.3 1.0
OP2 A:A288 4.4 0.6 1.0
N7 A:G117 4.4 0.4 1.0
C5 A:U118 4.5 0.6 1.0
C3' A:A116 4.5 0.5 1.0
OP1 A:G117 4.5 0.0 1.0
C4 A:U118 4.5 0.9 1.0
C8 A:A288 4.6 0.7 1.0
O5' A:G117 4.6 0.0 1.0
P A:A288 4.7 0.6 1.0
C2' A:A288 4.9 94.9 1.0
C5' A:A288 5.0 0.9 1.0
C8 A:G117 5.0 0.1 1.0

Magnesium binding site 7 out of 289 in 4dv2

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Magnesium binding site 7 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 7 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1607

b:0.5
occ:1.00
O A:HOH1916 2.1 0.9 1.0
O A:HOH1915 2.1 80.8 1.0
O A:HOH1914 2.1 0.6 1.0
O A:HOH1913 2.1 0.0 1.0
MG A:MG1769 3.7 0.8 1.0
OP1 A:C651 4.1 0.4 1.0
OP2 A:U652 4.4 0.2 1.0
OP2 A:U751 4.4 0.1 1.0
N7 A:G752 4.4 0.9 1.0
OP1 A:U751 4.6 0.9 1.0
OP2 A:C651 4.7 0.9 1.0
P A:C651 4.8 0.2 1.0
C8 A:G752 4.8 0.9 1.0
OP2 A:G752 4.9 0.6 1.0
P A:U751 4.9 0.5 1.0

Magnesium binding site 8 out of 289 in 4dv2

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Magnesium binding site 8 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 8 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1608

b:0.5
occ:1.00
O A:HOH1918 2.1 79.4 1.0
O A:HOH1919 2.1 0.2 1.0
O A:HOH1917 2.1 79.6 1.0
O6 A:G800 4.6 0.6 1.0
OP1 A:A781 4.6 0.8 1.0
O A:HOH2027 4.7 99.9 1.0
O6 A:G799 4.9 0.5 1.0

Magnesium binding site 9 out of 289 in 4dv2

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Magnesium binding site 9 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 9 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1609

b:0.4
occ:1.00
O2 A:U1506 3.0 0.4 1.0
O3' A:C795 3.0 0.2 1.0
O2' A:C795 3.3 0.8 1.0
OP1 A:C796 3.3 0.0 1.0
P A:C796 3.8 0.9 1.0
C2 A:U1506 3.9 0.0 1.0
C1' A:U1506 4.0 0.0 1.0
C3' A:C795 4.1 0.3 1.0
NZ K:LYS123 4.1 0.7 1.0
C2' A:C795 4.3 0.2 1.0
O4' A:U1506 4.3 0.1 1.0
N1 A:U1506 4.4 0.9 1.0
C4' A:C795 4.7 0.1 1.0
O3' A:U1506 4.7 0.8 1.0
OP2 A:C796 4.8 0.3 1.0
O5' A:C796 4.9 0.9 1.0
N3 A:U1506 5.0 0.9 1.0
C5' A:C796 5.0 0.9 1.0

Magnesium binding site 10 out of 289 in 4dv2

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Magnesium binding site 10 out of 289 in the Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 10 of Crystal Structure of the Thermus Thermophilus 30S Ribosomal Subunit with A 16S Rrna Mutation, C912A within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg1610

b:0.6
occ:1.00
O A:HOH1920 2.1 0.1 1.0
O A:HOH1921 2.1 66.1 1.0
OP1 A:G1508 2.5 0.3 1.0
OP1 A:G1505 2.6 0.0 1.0
OP1 A:A1500 2.6 0.3 1.0
O3' A:A1507 3.0 0.0 1.0
P A:G1508 3.3 0.6 1.0
C5' A:G1508 3.6 0.8 1.0
OP1 A:G1504 3.7 0.1 1.0
P A:A1500 3.9 0.4 1.0
OP2 A:C1501 3.9 0.4 1.0
C3' A:G1504 3.9 0.6 1.0
P A:G1505 3.9 0.8 1.0
O5' A:G1508 3.9 0.3 1.0
O5' A:G1504 4.0 0.6 1.0
C5' A:G1505 4.3 1.0 1.0
P A:G1504 4.3 0.9 1.0
OP2 A:A1500 4.3 0.1 1.0
C3' A:A1507 4.3 0.3 1.0
MG A:MG1718 4.4 96.9 1.0
O3' A:G1504 4.4 0.1 1.0
O2' A:A1507 4.5 0.3 1.0
O5' A:G1505 4.5 0.4 1.0
C2' A:G1504 4.5 0.8 1.0
OP2 A:G1508 4.5 0.1 1.0
C5' A:A1500 4.6 0.3 1.0
O5' A:A1500 4.6 0.5 1.0
O2' A:G1504 4.7 0.2 1.0
OP2 A:G1504 4.8 0.0 1.0
O2' A:U1506 4.8 0.1 1.0
C4' A:A1507 4.9 0.8 1.0
C2' A:A1507 5.0 0.4 1.0

Reference:

H.Demirci, F.Murphy Iv, E.Murphy, S.T.Gregory, A.E.Dahlberg, G.Jogl. A Structural Basis For Streptomycin Resistance To Be Published.
Page generated: Mon Dec 14 13:10:58 2020

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