Magnesium in PDB 7mlj: Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna
Enzymatic activity of Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna
All present enzymatic activity of Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna:
2.7.7.6;
Protein crystallography data
The structure of Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna, PDB code: 7mlj
was solved by
Y.Liu,
R.H.Ebright,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
46.21 /
3.75
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
186.309,
104.656,
298.413,
90,
98.12,
90
|
R / Rfree (%)
|
26.5 /
28.3
|
Other elements in 7mlj:
The structure of Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna also contains other interesting chemical elements:
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna
(pdb code 7mlj). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 5 binding sites of Magnesium where determined in the
Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna, PDB code: 7mlj:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
Magnesium binding site 1 out
of 5 in 7mlj
Go back to
Magnesium Binding Sites List in 7mlj
Magnesium binding site 1 out
of 5 in the Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna
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 Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg2001
b:139.3
occ:1.00
|
OD1
|
B:ASP183
|
2.2
|
150.8
|
1.0
|
OD1
|
B:ASP193
|
2.5
|
141.2
|
1.0
|
O
|
B:ASP191
|
3.1
|
144.1
|
1.0
|
CG
|
B:ASP183
|
3.4
|
151.6
|
1.0
|
OD1
|
B:ASP191
|
3.5
|
156.0
|
1.0
|
O
|
B:LEU192
|
3.5
|
141.6
|
1.0
|
C
|
B:ASP191
|
3.7
|
150.8
|
1.0
|
CG
|
B:ASP193
|
3.7
|
129.2
|
1.0
|
C
|
B:LEU192
|
3.9
|
142.8
|
1.0
|
OD2
|
B:ASP183
|
4.1
|
149.9
|
1.0
|
CG
|
B:ARG30
|
4.3
|
135.6
|
1.0
|
CA
|
B:ASP191
|
4.4
|
156.4
|
1.0
|
CA
|
B:ASP183
|
4.4
|
144.9
|
1.0
|
N
|
B:LEU192
|
4.4
|
149.5
|
1.0
|
N
|
B:ASP193
|
4.4
|
142.3
|
1.0
|
CB
|
B:ASP183
|
4.4
|
147.3
|
1.0
|
OD2
|
B:ASP193
|
4.5
|
122.2
|
1.0
|
CA
|
B:ASP193
|
4.5
|
133.1
|
1.0
|
CG
|
B:ASP191
|
4.5
|
152.0
|
1.0
|
CA
|
B:LEU192
|
4.6
|
143.6
|
1.0
|
CB
|
B:ASP193
|
4.8
|
128.7
|
1.0
|
CA
|
B:ARG30
|
4.9
|
137.5
|
1.0
|
CB
|
B:ASP191
|
4.9
|
153.3
|
1.0
|
CB
|
B:ARG30
|
5.0
|
136.6
|
1.0
|
N
|
B:ASP183
|
5.0
|
143.5
|
1.0
|
|
Magnesium binding site 2 out
of 5 in 7mlj
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Magnesium Binding Sites List in 7mlj
Magnesium binding site 2 out
of 5 in the Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna
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 Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg2002
b:92.5
occ:1.00
|
O
|
D:LYS840
|
2.2
|
130.1
|
1.0
|
OD2
|
B:ASP168
|
3.4
|
119.2
|
1.0
|
C
|
D:LYS840
|
3.5
|
136.7
|
1.0
|
OE2
|
B:GLU154
|
3.5
|
141.2
|
1.0
|
OD1
|
B:ASP168
|
3.5
|
122.2
|
1.0
|
CG
|
B:ASP168
|
3.9
|
121.9
|
1.0
|
CD
|
B:GLU154
|
4.3
|
147.7
|
1.0
|
N
|
D:TYR841
|
4.4
|
140.9
|
1.0
|
CA
|
D:LYS840
|
4.4
|
132.0
|
1.0
|
OE1
|
B:GLU154
|
4.4
|
149.8
|
1.0
|
CA
|
D:TYR841
|
4.4
|
137.8
|
1.0
|
CB
|
B:ALA153
|
4.6
|
142.6
|
1.0
|
O
|
D:LEU839
|
4.7
|
123.5
|
1.0
|
OE2
|
B:GLU64
|
4.7
|
172.9
|
1.0
|
N
|
D:VAL842
|
4.8
|
137.9
|
1.0
|
CG
|
D:LYS840
|
4.9
|
138.5
|
1.0
|
OE1
|
B:GLU64
|
5.0
|
182.1
|
1.0
|
|
Magnesium binding site 3 out
of 5 in 7mlj
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Magnesium Binding Sites List in 7mlj
Magnesium binding site 3 out
of 5 in the Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna
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 Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg2003
b:98.6
occ:1.00
|
OD1
|
D:ASP739
|
2.0
|
117.0
|
1.0
|
O3'
|
I:G4
|
2.0
|
126.4
|
1.0
|
OD1
|
D:ASP743
|
2.5
|
102.2
|
1.0
|
OD1
|
D:ASP741
|
2.7
|
103.4
|
1.0
|
OD2
|
D:ASP743
|
2.8
|
95.3
|
1.0
|
CG
|
D:ASP739
|
2.9
|
109.7
|
1.0
|
CG
|
D:ASP743
|
3.0
|
101.0
|
1.0
|
OD2
|
D:ASP739
|
3.2
|
114.9
|
1.0
|
C3'
|
I:G4
|
3.3
|
141.2
|
1.0
|
OD2
|
D:ASP741
|
3.4
|
114.3
|
1.0
|
O2'
|
I:G4
|
3.4
|
133.0
|
1.0
|
CG
|
D:ASP741
|
3.4
|
106.5
|
1.0
|
C2'
|
I:G4
|
3.8
|
141.5
|
1.0
|
C4'
|
I:G4
|
4.1
|
146.0
|
1.0
|
N
|
D:ASP739
|
4.2
|
104.3
|
1.0
|
CB
|
D:ASP739
|
4.3
|
96.8
|
1.0
|
NH2
|
D:ARG704
|
4.3
|
101.3
|
1.0
|
CB
|
D:ASP743
|
4.5
|
100.9
|
1.0
|
CA
|
D:ASP739
|
4.7
|
96.6
|
1.0
|
O
|
D:ASP739
|
4.7
|
105.2
|
1.0
|
C
|
D:ASP739
|
4.8
|
92.9
|
1.0
|
C5'
|
I:G4
|
4.9
|
148.2
|
1.0
|
CB
|
D:ASP741
|
4.9
|
99.1
|
1.0
|
|
Magnesium binding site 4 out
of 5 in 7mlj
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Magnesium Binding Sites List in 7mlj
Magnesium binding site 4 out
of 5 in the Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna
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 Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg2004
b:149.4
occ:1.00
|
O
|
D:TRP897
|
2.8
|
144.8
|
1.0
|
O
|
D:ILE900
|
2.8
|
145.5
|
1.0
|
O
|
D:GLU898
|
3.4
|
124.1
|
1.0
|
C
|
D:GLU898
|
3.9
|
134.2
|
1.0
|
C
|
D:TRP897
|
4.0
|
143.8
|
1.0
|
C
|
D:ILE900
|
4.0
|
136.9
|
1.0
|
CA
|
D:GLU898
|
4.1
|
139.1
|
1.0
|
N
|
D:ILE900
|
4.5
|
140.8
|
1.0
|
N
|
D:GLU898
|
4.5
|
139.2
|
1.0
|
NE1
|
D:TRP897
|
4.7
|
163.1
|
1.0
|
CD1
|
D:TRP897
|
4.7
|
159.5
|
1.0
|
CA
|
D:ILE900
|
4.8
|
137.6
|
1.0
|
N
|
D:LEU899
|
4.8
|
139.6
|
1.0
|
C
|
D:LEU899
|
4.9
|
137.7
|
1.0
|
|
Magnesium binding site 5 out
of 5 in 7mlj
Go back to
Magnesium Binding Sites List in 7mlj
Magnesium binding site 5 out
of 5 in the Crystal Structure of Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna
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 Thermus Thermophilus Reiterative Transcription Complex with 4NT Oligo-G Rna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Mg2001
b:147.6
occ:1.00
|
O
|
F:TRP299
|
2.0
|
154.9
|
1.0
|
O
|
F:ALA292
|
2.6
|
156.4
|
1.0
|
O
|
F:GLY296
|
2.6
|
178.5
|
1.0
|
C
|
F:TRP299
|
3.2
|
159.9
|
1.0
|
C
|
F:ALA292
|
3.3
|
163.3
|
1.0
|
C
|
F:GLY296
|
3.8
|
180.7
|
1.0
|
CA
|
F:TRP299
|
3.8
|
164.7
|
1.0
|
CB
|
F:TRP299
|
3.9
|
157.0
|
1.0
|
N
|
F:TRP299
|
3.9
|
168.9
|
1.0
|
N
|
F:GLU293
|
4.0
|
165.1
|
1.0
|
CB
|
F:ALA292
|
4.0
|
160.4
|
1.0
|
CA
|
F:ALA292
|
4.1
|
161.0
|
1.0
|
CA
|
F:GLU293
|
4.1
|
163.3
|
1.0
|
N
|
F:ASP300
|
4.3
|
159.5
|
1.0
|
N
|
F:GLY296
|
4.5
|
174.1
|
1.0
|
CA
|
F:ASP300
|
4.6
|
167.3
|
1.0
|
CA
|
F:GLY296
|
4.6
|
180.4
|
1.0
|
N
|
F:PRO297
|
4.7
|
177.1
|
1.0
|
CA
|
F:PRO297
|
4.7
|
176.5
|
1.0
|
O
|
F:GLU293
|
4.8
|
162.2
|
1.0
|
C
|
F:GLU293
|
4.8
|
160.6
|
1.0
|
C
|
F:PRO297
|
4.9
|
172.1
|
1.0
|
|
Reference:
Y.Liu,
L.Yu,
C.Pukhrambam,
J.T.Winkelman,
E.Firlar,
J.T.Kaelber,
Y.Zhang,
B.E.Nickels,
R.H.Ebright.
Structural and Mechanistic Basis of Reiterative Transcription Initiation. Proc.Natl.Acad.Sci.Usa V. 119 2022.
ISSN: ESSN 1091-6490
PubMed: 35082149
DOI: 10.1073/PNAS.2115746119
Page generated: Wed Apr 5 13:20:58 2023
|