Zinc in PDB 7riy: Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp

Enzymatic activity of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp

All present enzymatic activity of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp:
2.7.7.6;

Protein crystallography data

The structure of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp, PDB code: 7riy was solved by J.Oh, P.B.Dervan, D.Wang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 49.53 / 3.70
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 167.775, 222.76, 192.956, 90, 100.54, 90
R / Rfree (%) 23.2 / 28.1

Other elements in 7riy:

The structure of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp also contains other interesting chemical elements:

Magnesium (Mg) 1 atom

Zinc Binding Sites:

The binding sites of Zinc atom in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp (pdb code 7riy). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 8 binding sites of Zinc where determined in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp, PDB code: 7riy:
Jump to Zinc binding site number: 1; 2; 3; 4; 5; 6; 7; 8;

Zinc binding site 1 out of 8 in 7riy

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Zinc binding site 1 out of 8 in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn1801

b:242.3
occ:1.00
N A:CYS110 2.0 228.1 1.0
SG A:CYS107 2.3 216.9 1.0
SG A:CYS110 2.4 212.6 1.0
SG A:CYS167 2.5 245.1 1.0
CB A:CYS167 2.7 240.9 1.0
CB A:CYS110 2.8 215.9 1.0
CA A:CYS110 2.9 218.0 1.0
CB A:HIS109 3.0 219.1 1.0
C A:HIS109 3.0 229.0 1.0
CA A:HIS109 3.3 220.3 1.0
CB A:CYS107 3.5 212.8 1.0
N A:HIS109 3.5 213.0 1.0
O A:CYS110 3.7 206.8 1.0
C A:CYS110 3.8 208.5 1.0
CA A:CYS167 3.9 235.3 1.0
N A:CYS167 4.0 230.2 1.0
O A:HIS109 4.1 228.1 1.0
CG A:HIS109 4.2 215.6 1.0
SG A:CYS148 4.4 217.6 1.0
C A:CYS107 4.5 210.9 1.0
ND2 A:ASN169 4.5 221.5 1.0
CA A:CYS107 4.6 208.8 1.0
C A:MET108 4.6 213.0 1.0
N A:GLY168 4.7 243.8 1.0
ND1 A:HIS109 4.7 212.7 1.0
O A:CYS107 4.7 211.0 1.0
CB A:CYS148 4.8 214.9 1.0
N A:MET108 4.8 214.6 1.0
C A:CYS167 4.8 230.8 1.0

Zinc binding site 2 out of 8 in 7riy

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Zinc binding site 2 out of 8 in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn1802

b:168.0
occ:1.00
NE2 A:HIS80 1.9 168.9 1.0
CE1 A:HIS80 2.1 173.2 1.0
SG A:CYS77 2.1 155.5 1.0
SG A:CYS67 2.4 181.4 1.0
CB A:CYS70 2.5 182.4 1.0
CB A:CYS67 2.8 180.1 1.0
SG A:CYS70 2.8 179.9 1.0
CD2 A:HIS80 3.2 171.7 1.0
ND1 A:HIS80 3.4 170.5 1.0
CB A:CYS77 3.5 157.7 1.0
CG A:HIS80 3.9 170.6 1.0
CA A:CYS70 3.9 185.5 1.0
CA A:CYS67 4.1 180.1 1.0
C A:CYS67 4.3 185.8 1.0
N A:GLN68 4.4 183.9 1.0
O A:PRO78 4.4 154.0 1.0
C A:CYS70 4.5 172.4 1.0
N A:CYS70 4.6 201.0 1.0
N A:GLN71 4.7 185.8 1.0
CA A:CYS77 4.7 156.1 1.0
O A:GLN68 4.7 212.6 1.0
O A:ARG57 4.7 178.1 1.0
O A:CYS67 4.9 185.2 1.0
O A:LEU58 4.9 178.0 1.0

Zinc binding site 3 out of 8 in 7riy

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Zinc binding site 3 out of 8 in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn1301

b:195.2
occ:1.00
N B:CYS1166 2.2 177.8 1.0
SG B:CYS1166 2.3 158.3 1.0
SG B:CYS1185 2.4 177.8 1.0
SG B:CYS1163 2.5 178.7 1.0
CB B:CYS1166 2.6 164.2 1.0
CA B:CYS1166 2.8 170.9 1.0
CB B:CYS1185 2.9 176.2 1.0
SG B:CYS1182 3.1 171.3 1.0
C B:ILE1165 3.3 181.1 1.0
CB B:ILE1165 3.4 166.4 1.0
CB B:CYS1163 3.7 173.6 1.0
O B:CYS1166 3.7 172.8 1.0
C B:CYS1166 3.7 169.4 1.0
CA B:ILE1165 3.8 172.0 1.0
CG2 B:ILE1165 4.0 166.7 1.0
N B:ILE1165 4.1 171.7 1.0
CA B:CYS1185 4.3 175.8 1.0
O B:ILE1165 4.3 176.1 1.0
CG1 B:ILE1165 4.5 161.5 1.0
CB B:CYS1182 4.5 171.1 1.0
N B:CYS1185 4.6 177.0 1.0
ND2 B:ASN1187 4.8 181.6 1.0
CB B:ASN1187 4.9 178.9 1.0
N B:GLY1167 5.0 168.7 1.0
CA B:CYS1163 5.0 169.3 1.0

Zinc binding site 4 out of 8 in 7riy

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Zinc binding site 4 out of 8 in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 4 of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Zn401

b:108.5
occ:1.00
SG C:CYS95 2.3 88.6 1.0
SG C:CYS88 2.4 80.7 1.0
SG C:CYS86 2.5 96.6 1.0
SG C:CYS92 2.5 99.7 1.0
CB C:CYS92 2.6 99.8 1.0
N C:CYS92 2.7 97.2 1.0
CB C:CYS95 2.8 92.7 1.0
CB C:CYS86 3.0 95.6 1.0
CA C:CYS92 3.2 96.3 1.0
CB C:CYS88 3.4 81.2 1.0
C C:HIS91 3.8 98.2 1.0
N C:CYS95 4.0 104.7 1.0
CA C:CYS95 4.0 96.8 1.0
C C:CYS92 4.0 91.6 1.0
N C:CYS88 4.2 87.9 1.0
CA C:HIS91 4.2 94.5 1.0
CA C:CYS88 4.4 88.1 1.0
CA C:CYS86 4.4 98.6 1.0
O C:CYS92 4.4 91.3 1.0
C C:CYS86 4.7 96.0 1.0
N C:PHE87 4.7 88.6 1.0
N C:ASP93 4.8 91.8 1.0
C C:LYS94 4.8 107.5 1.0
C C:CYS95 4.8 90.5 1.0
O C:HIS91 4.9 98.5 1.0

Zinc binding site 5 out of 8 in 7riy

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Zinc binding site 5 out of 8 in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 5 of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Zn201

b:99.5
occ:1.00
OG1 I:THR31 2.0 126.7 1.0
SG I:CYS29 2.4 120.5 1.0
SG I:CYS7 2.5 101.9 1.0
SG I:CYS32 2.6 124.6 1.0
CB I:CYS7 2.6 103.2 1.0
SG I:CYS10 2.9 129.2 1.0
CB I:CYS29 3.3 116.5 1.0
CB I:CYS10 3.4 118.1 1.0
CB I:THR31 3.4 123.4 1.0
N I:CYS32 3.6 118.1 1.0
CB I:CYS32 4.0 125.7 1.0
CG2 I:THR31 4.0 116.5 1.0
CA I:CYS7 4.1 105.3 1.0
N I:CYS10 4.2 115.5 1.0
CA I:THR31 4.2 111.1 1.0
N I:THR31 4.2 105.5 1.0
C I:THR31 4.3 111.0 1.0
CA I:CYS10 4.4 112.0 1.0
CA I:CYS32 4.4 123.5 1.0
CB I:TYR34 4.5 98.1 1.0
C I:CYS7 4.8 105.0 1.0
CA I:CYS29 4.8 116.2 1.0
N I:CYS7 4.9 110.3 1.0
O I:CYS7 4.9 108.8 1.0
CB I:ASP9 4.9 112.0 1.0
C I:CYS32 5.0 124.8 1.0

Zinc binding site 6 out of 8 in 7riy

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Zinc binding site 6 out of 8 in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 6 of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Zn202

b:110.3
occ:1.00
SG I:CYS106 2.2 98.5 1.0
SG I:CYS78 2.4 85.6 1.0
SG I:CYS103 2.4 104.5 1.0
SG I:CYS75 2.5 118.8 1.0
CB I:CYS75 2.7 113.2 1.0
CB I:CYS103 2.8 98.8 1.0
OG I:SER80 3.4 105.8 1.0
CB I:CYS78 3.4 96.7 1.0
CB I:CYS106 3.5 106.6 1.0
N I:CYS106 3.9 115.3 1.0
N I:CYS78 3.9 111.5 1.0
CA I:CYS78 4.2 106.1 1.0
CA I:CYS106 4.2 110.9 1.0
CA I:CYS75 4.2 108.6 1.0
CB I:HIS108 4.2 98.5 1.0
CA I:CYS103 4.3 92.8 1.0
N I:HIS79 4.6 99.6 1.0
C I:CYS78 4.6 97.9 1.0
N I:HIS108 4.7 99.4 1.0
N I:SER80 4.7 105.9 1.0
CB I:SER80 4.7 103.2 1.0
C I:CYS106 4.7 107.0 1.0
C I:SER105 4.8 114.4 1.0
N I:SER107 4.9 104.1 1.0
C I:CYS103 4.9 94.5 1.0
N I:SER105 4.9 106.4 1.0
CB I:SER105 4.9 113.9 1.0
C I:CYS75 5.0 112.2 1.0
N I:CYS75 5.0 104.7 1.0

Zinc binding site 7 out of 8 in 7riy

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Zinc binding site 7 out of 8 in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 7 of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp within 5.0Å range:
probe atom residue distance (Å) B Occ
J:Zn101

b:90.8
occ:1.00
SG J:CYS10 2.4 89.7 1.0
SG J:CYS7 2.4 75.5 1.0
CB J:CYS7 2.4 76.2 1.0
SG J:CYS45 2.5 95.8 1.0
SG J:CYS46 2.6 96.4 1.0
N J:CYS46 2.9 99.9 1.0
NH2 J:ARG43 3.1 86.1 1.0
C J:CYS45 3.1 94.3 1.0
CA J:CYS46 3.2 93.8 1.0
CB J:CYS46 3.3 93.9 1.0
O J:CYS45 3.5 97.6 1.0
CB J:CYS45 3.6 91.0 1.0
CB J:CYS10 3.6 88.1 1.0
N J:CYS10 3.9 91.8 1.0
CA J:CYS7 3.9 78.4 1.0
CA J:CYS45 3.9 86.3 1.0
CZ J:ARG43 4.3 88.8 1.0
CA J:CYS10 4.3 90.2 1.0
N J:GLY11 4.5 83.9 1.0
C J:CYS7 4.5 82.4 1.0
N J:CYS7 4.6 75.8 1.0
O J:CYS7 4.6 87.7 1.0
C J:CYS46 4.7 85.6 1.0
NE J:ARG43 4.7 91.7 1.0
N J:LYS12 4.8 79.0 1.0
N J:CYS45 4.8 76.0 1.0
CB J:SER9 4.8 82.8 1.0
C J:CYS10 5.0 89.9 1.0
CB J:LYS12 5.0 67.4 1.0

Zinc binding site 8 out of 8 in 7riy

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Zinc binding site 8 out of 8 in the Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 8 of Rna Polymerase II Elongation Complex with Hairpin Polyamide Py-Im 1, Scaffold 2 Soaked with Utp within 5.0Å range:
probe atom residue distance (Å) B Occ
L:Zn101

b:182.6
occ:1.00
SG L:CYS48 2.3 203.0 1.0
SG L:CYS34 2.3 175.8 1.0
CB L:CYS51 2.4 216.2 1.0
SG L:CYS51 2.4 211.9 1.0
SG L:CYS31 2.6 191.4 1.0
CB L:CYS31 3.0 182.6 1.0
CB L:CYS48 3.0 199.7 1.0
CB L:CYS34 3.1 177.5 1.0
N L:CYS51 3.5 211.5 1.0
CA L:CYS51 3.5 215.4 1.0
OG L:SER36 3.9 169.5 1.0
N L:CYS34 4.0 174.8 1.0
CA L:CYS34 4.1 174.7 1.0
C L:CYS51 4.4 213.7 1.0
CA L:CYS48 4.5 195.5 1.0
CA L:CYS31 4.5 173.2 1.0
C L:ASP50 4.5 213.3 1.0
N L:GLY52 4.5 208.4 1.0
C L:CYS34 4.8 169.6 1.0
O L:CYS48 4.8 200.0 1.0
C L:CYS48 4.9 196.9 1.0
C L:CYS31 5.0 172.9 1.0
N L:SER35 5.0 175.3 1.0

Reference:

J.Oh, T.Jia, J.Xu, J.Chong, P.B.Dervan, D.Wang. Rna Polymerase II Trapped on A Molecular Treadmill: Structural Basis of Persistent Transcriptional Arrest By A Minor Groove Dna Binder. Proc.Natl.Acad.Sci.Usa V. 119 2022.
ISSN: ESSN 1091-6490
PubMed: 35022237
DOI: 10.1073/PNAS.2114065119
Page generated: Wed Oct 30 10:22:50 2024

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