Zinc in PDB 8ukr: Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
Enzymatic activity of Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
All present enzymatic activity of Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry:
2.7.7.6;
Protein crystallography data
The structure of Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry, PDB code: 8ukr
was solved by
P.Hou,
J.Oh,
D.Wang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
47.96 /
3.78
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
159.617,
222.632,
190.697,
90,
97.69,
90
|
R / Rfree (%)
|
26.1 /
31
|
Other elements in 8ukr:
The structure of Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry also contains other interesting chemical elements:
Zinc Binding Sites:
The binding sites of Zinc atom in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
(pdb code 8ukr). 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 Fapy-Dg Lesion Soaking with Atp Before Chemistry, PDB code: 8ukr:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Zinc binding site 1 out
of 8 in 8ukr
Go back to
Zinc Binding Sites List in 8ukr
Zinc binding site 1 out
of 8 in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
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 Fapy-Dg Lesion Soaking with Atp Before Chemistry within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1801
b:342.5
occ:1.00
|
SG
|
A:CYS110
|
2.3
|
245.7
|
1.0
|
SG
|
A:CYS167
|
2.3
|
285.2
|
1.0
|
SG
|
A:CYS107
|
2.3
|
225.2
|
1.0
|
SG
|
A:CYS148
|
2.3
|
278.9
|
1.0
|
CB
|
A:CYS167
|
3.2
|
241.2
|
1.0
|
CB
|
A:CYS110
|
3.3
|
219.1
|
1.0
|
CB
|
A:CYS107
|
3.4
|
212.7
|
1.0
|
CB
|
A:CYS148
|
3.5
|
249.7
|
1.0
|
O
|
A:ASN169
|
3.6
|
276.8
|
1.0
|
N
|
A:GLY168
|
3.8
|
331.0
|
1.0
|
CA
|
A:CYS167
|
3.9
|
241.5
|
1.0
|
N
|
A:CYS110
|
4.1
|
222.2
|
1.0
|
C
|
A:CYS167
|
4.2
|
267.8
|
1.0
|
N
|
A:CYS148
|
4.2
|
211.4
|
1.0
|
N
|
A:ASN169
|
4.3
|
317.0
|
1.0
|
CA
|
A:CYS110
|
4.3
|
219.7
|
1.0
|
CA
|
A:CYS148
|
4.4
|
218.9
|
1.0
|
C
|
A:ASN169
|
4.7
|
274.2
|
1.0
|
CA
|
A:CYS107
|
4.8
|
204.7
|
1.0
|
CA
|
A:GLY168
|
4.8
|
329.2
|
1.0
|
O
|
A:CYS148
|
4.9
|
220.4
|
1.0
|
|
Zinc binding site 2 out
of 8 in 8ukr
Go back to
Zinc Binding Sites List in 8ukr
Zinc binding site 2 out
of 8 in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
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 Fapy-Dg Lesion Soaking with Atp Before Chemistry within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn1802
b:208.4
occ:1.00
|
NE2
|
A:HIS80
|
2.2
|
256.1
|
1.0
|
SG
|
A:CYS77
|
2.3
|
153.5
|
1.0
|
SG
|
A:CYS67
|
2.3
|
231.7
|
1.0
|
SG
|
A:CYS70
|
2.3
|
210.6
|
1.0
|
CE1
|
A:HIS80
|
3.0
|
260.4
|
1.0
|
CB
|
A:CYS70
|
3.2
|
178.0
|
1.0
|
CB
|
A:CYS77
|
3.2
|
145.1
|
1.0
|
O
|
A:LEU58
|
3.2
|
216.5
|
1.0
|
CD2
|
A:HIS80
|
3.2
|
247.5
|
1.0
|
CB
|
A:CYS67
|
3.5
|
212.7
|
1.0
|
O
|
A:ARG57
|
3.6
|
221.2
|
1.0
|
N
|
A:GLN68
|
3.9
|
215.3
|
1.0
|
CA
|
A:CYS77
|
4.1
|
157.3
|
1.0
|
ND1
|
A:HIS80
|
4.1
|
259.9
|
1.0
|
C
|
A:LEU58
|
4.2
|
212.3
|
1.0
|
N
|
A:GLY79
|
4.2
|
182.1
|
1.0
|
CG
|
A:HIS80
|
4.3
|
249.5
|
1.0
|
CA
|
A:CYS67
|
4.3
|
203.3
|
1.0
|
CA
|
A:CYS70
|
4.4
|
196.5
|
1.0
|
N
|
A:CYS70
|
4.5
|
222.4
|
1.0
|
C
|
A:CYS67
|
4.5
|
211.2
|
1.0
|
C
|
A:CYS77
|
4.6
|
173.0
|
1.0
|
CA
|
A:GLY79
|
4.6
|
166.3
|
1.0
|
CD
|
A:PRO78
|
4.7
|
187.0
|
1.0
|
CA
|
A:LEU58
|
4.7
|
207.9
|
1.0
|
C
|
A:ARG57
|
4.7
|
225.6
|
1.0
|
N
|
A:PRO78
|
4.7
|
191.6
|
1.0
|
CA
|
A:GLN68
|
4.8
|
200.8
|
1.0
|
O
|
A:GLN68
|
4.8
|
163.4
|
1.0
|
CB
|
A:GLN68
|
4.8
|
188.6
|
1.0
|
C
|
A:GLN68
|
4.9
|
190.0
|
1.0
|
|
Zinc binding site 3 out
of 8 in 8ukr
Go back to
Zinc Binding Sites List in 8ukr
Zinc binding site 3 out
of 8 in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
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 Fapy-Dg Lesion Soaking with Atp Before Chemistry within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn1301
b:216.8
occ:1.00
|
SG
|
B:CYS1182
|
2.3
|
228.6
|
1.0
|
SG
|
B:CYS1163
|
2.3
|
183.2
|
1.0
|
SG
|
B:CYS1185
|
2.3
|
213.1
|
1.0
|
SG
|
B:CYS1166
|
2.3
|
145.7
|
1.0
|
CB
|
B:CYS1166
|
2.9
|
159.2
|
1.0
|
N
|
B:CYS1166
|
3.1
|
194.7
|
1.0
|
CB
|
B:CYS1163
|
3.2
|
171.2
|
1.0
|
CB
|
B:CYS1185
|
3.3
|
197.1
|
1.0
|
CB
|
B:CYS1182
|
3.5
|
203.0
|
1.0
|
CA
|
B:CYS1166
|
3.5
|
189.3
|
1.0
|
CA
|
B:CYS1185
|
3.8
|
168.8
|
1.0
|
N
|
B:CYS1185
|
4.1
|
167.2
|
1.0
|
C
|
B:ILE1165
|
4.1
|
175.4
|
1.0
|
CB
|
B:ILE1165
|
4.1
|
170.8
|
1.0
|
O
|
B:LYS1183
|
4.4
|
237.7
|
1.0
|
CA
|
B:ILE1165
|
4.5
|
164.7
|
1.0
|
N
|
B:ILE1165
|
4.6
|
161.1
|
1.0
|
CA
|
B:CYS1163
|
4.6
|
157.4
|
1.0
|
CB
|
B:THR1170
|
4.7
|
161.0
|
1.0
|
CG2
|
B:ILE1165
|
4.8
|
153.9
|
1.0
|
CA
|
B:CYS1182
|
4.8
|
184.8
|
1.0
|
C
|
B:GLY1184
|
4.9
|
159.9
|
1.0
|
C
|
B:CYS1166
|
4.9
|
174.8
|
1.0
|
C
|
B:CYS1182
|
4.9
|
195.2
|
1.0
|
C
|
B:CYS1163
|
4.9
|
172.6
|
1.0
|
OG1
|
B:THR1170
|
5.0
|
173.6
|
1.0
|
O
|
B:LEU1168
|
5.0
|
164.3
|
1.0
|
|
Zinc binding site 4 out
of 8 in 8ukr
Go back to
Zinc Binding Sites List in 8ukr
Zinc binding site 4 out
of 8 in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
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 Fapy-Dg Lesion Soaking with Atp Before Chemistry within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn401
b:158.5
occ:1.00
|
SG
|
C:CYS92
|
2.3
|
60.8
|
1.0
|
SG
|
C:CYS88
|
2.3
|
71.8
|
1.0
|
SG
|
C:CYS86
|
2.3
|
89.5
|
1.0
|
SG
|
C:CYS95
|
2.3
|
104.0
|
1.0
|
N
|
C:CYS92
|
2.8
|
105.3
|
1.0
|
CB
|
C:CYS92
|
3.1
|
96.6
|
1.0
|
CB
|
C:CYS95
|
3.1
|
107.3
|
1.0
|
CB
|
C:CYS88
|
3.3
|
63.3
|
1.0
|
CB
|
C:CYS86
|
3.3
|
139.4
|
1.0
|
CA
|
C:CYS92
|
3.4
|
91.8
|
1.0
|
C
|
C:HIS91
|
3.8
|
125.6
|
1.0
|
O
|
C:CYS92
|
4.1
|
74.2
|
1.0
|
CA
|
C:HIS91
|
4.1
|
114.2
|
1.0
|
C
|
C:CYS92
|
4.2
|
58.8
|
1.0
|
N
|
C:CYS88
|
4.2
|
98.3
|
1.0
|
CA
|
C:CYS88
|
4.3
|
65.1
|
1.0
|
CA
|
C:CYS95
|
4.3
|
103.6
|
1.0
|
N
|
C:CYS95
|
4.3
|
102.1
|
1.0
|
CA
|
C:SER83
|
4.6
|
71.1
|
1.0
|
CA
|
C:CYS86
|
4.6
|
147.2
|
1.0
|
O
|
C:HIS91
|
4.7
|
129.3
|
1.0
|
C
|
C:CYS86
|
4.8
|
143.6
|
1.0
|
O
|
C:SER83
|
4.8
|
113.6
|
1.0
|
C
|
C:CYS88
|
4.8
|
102.3
|
1.0
|
N
|
C:HIS91
|
4.8
|
128.4
|
1.0
|
CB
|
C:SER83
|
4.9
|
90.7
|
1.0
|
|
Zinc binding site 5 out
of 8 in 8ukr
Go back to
Zinc Binding Sites List in 8ukr
Zinc binding site 5 out
of 8 in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
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 Fapy-Dg Lesion Soaking with Atp Before Chemistry within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Zn201
b:216.8
occ:1.00
|
SG
|
I:CYS7
|
2.3
|
116.7
|
1.0
|
SG
|
I:CYS10
|
2.3
|
234.4
|
1.0
|
SG
|
I:CYS32
|
2.3
|
149.8
|
1.0
|
SG
|
I:CYS29
|
2.3
|
224.2
|
1.0
|
N
|
I:CYS32
|
2.8
|
134.5
|
1.0
|
CB
|
I:CYS32
|
2.9
|
137.6
|
1.0
|
CB
|
I:THR31
|
3.2
|
171.1
|
1.0
|
C
|
I:THR31
|
3.3
|
139.2
|
1.0
|
CB
|
I:CYS10
|
3.3
|
176.2
|
1.0
|
CA
|
I:CYS32
|
3.4
|
149.2
|
1.0
|
CB
|
I:CYS29
|
3.6
|
156.3
|
1.0
|
CA
|
I:THR31
|
3.7
|
153.8
|
1.0
|
CB
|
I:ASN12
|
3.8
|
146.9
|
1.0
|
CG2
|
I:THR31
|
3.9
|
158.6
|
1.0
|
CB
|
I:CYS7
|
3.9
|
112.9
|
1.0
|
O
|
I:THR31
|
4.1
|
133.2
|
1.0
|
N
|
I:THR31
|
4.1
|
147.1
|
1.0
|
OG1
|
I:THR31
|
4.1
|
183.7
|
1.0
|
N
|
I:ASN12
|
4.2
|
120.4
|
1.0
|
CA
|
I:CYS10
|
4.3
|
166.8
|
1.0
|
N
|
I:CYS10
|
4.4
|
150.9
|
1.0
|
ND2
|
I:ASN12
|
4.4
|
148.8
|
1.0
|
C
|
I:CYS32
|
4.5
|
152.6
|
1.0
|
O
|
I:CYS32
|
4.5
|
157.4
|
1.0
|
C
|
I:CYS10
|
4.5
|
176.8
|
1.0
|
CG
|
I:ASN12
|
4.5
|
150.8
|
1.0
|
CA
|
I:ASN12
|
4.6
|
130.5
|
1.0
|
N
|
I:ASN11
|
4.6
|
146.6
|
1.0
|
O
|
I:ASN12
|
4.9
|
133.0
|
1.0
|
CA
|
I:CYS29
|
4.9
|
156.8
|
1.0
|
O
|
I:CYS7
|
5.0
|
159.5
|
1.0
|
|
Zinc binding site 6 out
of 8 in 8ukr
Go back to
Zinc Binding Sites List in 8ukr
Zinc binding site 6 out
of 8 in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
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 Fapy-Dg Lesion Soaking with Atp Before Chemistry within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Zn202
b:287.5
occ:1.00
|
N
|
I:CYS78
|
2.3
|
229.6
|
1.0
|
SG
|
I:CYS103
|
2.3
|
271.4
|
1.0
|
SG
|
I:CYS78
|
2.3
|
223.1
|
1.0
|
SG
|
I:CYS75
|
2.3
|
280.4
|
1.0
|
SG
|
I:CYS106
|
2.3
|
204.0
|
1.0
|
CB
|
I:CYS78
|
2.9
|
205.2
|
1.0
|
CA
|
I:CYS78
|
3.0
|
209.3
|
1.0
|
CB
|
I:CYS75
|
3.2
|
195.2
|
1.0
|
C
|
I:LYS77
|
3.3
|
257.0
|
1.0
|
CB
|
I:CYS103
|
3.4
|
224.3
|
1.0
|
CB
|
I:LYS77
|
3.6
|
210.8
|
1.0
|
CA
|
I:LYS77
|
3.7
|
221.5
|
1.0
|
O
|
I:SER105
|
3.7
|
238.5
|
1.0
|
CB
|
I:CYS106
|
3.8
|
208.2
|
1.0
|
N
|
I:LYS77
|
3.8
|
210.5
|
1.0
|
CB
|
I:HIS108
|
3.8
|
196.9
|
1.0
|
ND1
|
I:HIS108
|
4.0
|
201.9
|
1.0
|
O
|
I:CYS75
|
4.3
|
223.3
|
1.0
|
O
|
I:LYS77
|
4.3
|
270.5
|
1.0
|
C
|
I:CYS78
|
4.3
|
213.0
|
1.0
|
C
|
I:CYS75
|
4.4
|
226.6
|
1.0
|
CA
|
I:CYS75
|
4.4
|
196.9
|
1.0
|
CG
|
I:HIS108
|
4.4
|
196.6
|
1.0
|
N
|
I:HIS79
|
4.5
|
212.1
|
1.0
|
N
|
I:HIS108
|
4.6
|
193.6
|
1.0
|
O
|
I:HIS108
|
4.7
|
187.5
|
1.0
|
CA
|
I:CYS103
|
4.7
|
187.8
|
1.0
|
CA
|
I:HIS108
|
4.7
|
193.2
|
1.0
|
C
|
I:PRO76
|
4.7
|
210.7
|
1.0
|
CG
|
I:LYS77
|
4.8
|
212.4
|
1.0
|
CA
|
I:CYS106
|
4.8
|
206.9
|
1.0
|
C
|
I:SER105
|
4.8
|
233.4
|
1.0
|
C
|
I:CYS106
|
4.9
|
202.9
|
1.0
|
|
Zinc binding site 7 out
of 8 in 8ukr
Go back to
Zinc Binding Sites List in 8ukr
Zinc binding site 7 out
of 8 in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
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 Fapy-Dg Lesion Soaking with Atp Before Chemistry within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Zn101
b:115.9
occ:1.00
|
SG
|
J:CYS10
|
2.3
|
117.2
|
1.0
|
SG
|
J:CYS7
|
2.3
|
54.0
|
1.0
|
SG
|
J:CYS46
|
2.3
|
40.6
|
1.0
|
SG
|
J:CYS45
|
2.3
|
145.0
|
1.0
|
CB
|
J:CYS10
|
2.8
|
69.1
|
1.0
|
N
|
J:CYS46
|
3.0
|
115.5
|
1.0
|
CB
|
J:CYS7
|
3.3
|
66.2
|
1.0
|
CB
|
J:CYS45
|
3.4
|
104.7
|
1.0
|
CB
|
J:CYS46
|
3.5
|
113.1
|
1.0
|
CA
|
J:CYS46
|
3.5
|
112.2
|
1.0
|
OG
|
J:SER9
|
3.5
|
77.2
|
1.0
|
N
|
J:CYS10
|
3.6
|
63.7
|
1.0
|
C
|
J:CYS45
|
3.6
|
106.2
|
1.0
|
CB
|
J:ARG43
|
3.8
|
108.6
|
1.0
|
CA
|
J:CYS10
|
3.8
|
88.9
|
1.0
|
CA
|
J:CYS45
|
4.0
|
91.0
|
1.0
|
NH1
|
J:ARG43
|
4.3
|
108.0
|
1.0
|
CZ
|
J:ARG43
|
4.3
|
119.1
|
1.0
|
CG
|
J:ARG43
|
4.4
|
125.2
|
1.0
|
O
|
J:CYS45
|
4.4
|
95.5
|
1.0
|
N
|
J:CYS45
|
4.5
|
87.4
|
1.0
|
NH2
|
J:ARG43
|
4.5
|
122.1
|
1.0
|
NH2
|
J:ARG48
|
4.7
|
58.6
|
1.0
|
NE
|
J:ARG43
|
4.7
|
121.7
|
1.0
|
CA
|
J:CYS7
|
4.8
|
102.1
|
1.0
|
O
|
J:ARG43
|
4.8
|
97.1
|
1.0
|
C
|
J:SER9
|
4.8
|
75.2
|
1.0
|
CB
|
J:SER9
|
4.9
|
89.5
|
1.0
|
|
Zinc binding site 8 out
of 8 in 8ukr
Go back to
Zinc Binding Sites List in 8ukr
Zinc binding site 8 out
of 8 in the Rna Polymerase II Elongation Complex with Fapy-Dg Lesion Soaking with Atp Before Chemistry
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 Fapy-Dg Lesion Soaking with Atp Before Chemistry within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
L:Zn101
b:369.9
occ:1.00
|
SG
|
L:CYS48
|
2.3
|
347.5
|
1.0
|
SG
|
L:CYS34
|
2.3
|
429.0
|
1.0
|
SG
|
L:CYS31
|
2.3
|
343.4
|
1.0
|
SG
|
L:CYS51
|
2.3
|
328.7
|
1.0
|
CB
|
L:CYS31
|
3.1
|
277.9
|
1.0
|
CB
|
L:CYS51
|
3.4
|
323.7
|
1.0
|
CB
|
L:CYS34
|
3.5
|
387.4
|
1.0
|
O
|
L:HIS53
|
3.5
|
237.4
|
1.0
|
N
|
L:CYS34
|
3.8
|
400.8
|
1.0
|
CB
|
L:CYS48
|
3.8
|
335.9
|
1.0
|
O
|
L:ILE55
|
3.9
|
182.5
|
1.0
|
CA
|
L:CYS34
|
4.3
|
395.3
|
1.0
|
N
|
L:CYS48
|
4.3
|
319.4
|
1.0
|
O
|
L:CYS51
|
4.4
|
318.4
|
1.0
|
CA
|
L:CYS51
|
4.4
|
319.4
|
1.0
|
CA
|
L:CYS31
|
4.5
|
286.7
|
1.0
|
CA
|
L:CYS48
|
4.6
|
321.9
|
1.0
|
C
|
L:CYS51
|
4.7
|
306.7
|
1.0
|
C
|
L:HIS53
|
4.7
|
233.2
|
1.0
|
N
|
L:CYS51
|
4.7
|
329.6
|
1.0
|
C
|
L:CYS31
|
4.8
|
322.1
|
1.0
|
CB
|
L:GLU33
|
4.8
|
313.3
|
1.0
|
C
|
L:GLU33
|
4.8
|
327.0
|
1.0
|
O
|
L:CYS48
|
4.9
|
325.4
|
1.0
|
N
|
L:GLU33
|
5.0
|
321.1
|
1.0
|
O
|
L:CYS31
|
5.0
|
336.2
|
1.0
|
|
Reference:
S.Gao,
P.Hou,
J.Oh,
D.Wang,
M.M.Greenberg.
Molecular Mechanism of Rna Polymerase II Transcriptional Mutagenesis By the Epimerizable Dna Lesion, Fapy·Dg. J.Am.Chem.Soc. V. 146 6274 2024.
ISSN: ESSN 1520-5126
PubMed: 38393762
DOI: 10.1021/JACS.3C14476
Page generated: Thu Oct 31 12:19:13 2024
|