Magnesium in PDB 7r6v: Human Exog Complexed with Drp-Containing Dna
Protein crystallography data
The structure of Human Exog Complexed with Drp-Containing Dna, PDB code: 7r6v
was solved by
M.R.Szymanski,
Y.W.Yin,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
50.00 /
2.16
|
Space group
|
P 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
73.749,
79.085,
79.635,
69.05,
65.02,
89.72
|
R / Rfree (%)
|
20 /
24
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Human Exog Complexed with Drp-Containing Dna
(pdb code 7r6v). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 6 binding sites of Magnesium where determined in the
Human Exog Complexed with Drp-Containing Dna, PDB code: 7r6v:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
Magnesium binding site 1 out
of 6 in 7r6v
Go back to
Magnesium Binding Sites List in 7r6v
Magnesium binding site 1 out
of 6 in the Human Exog Complexed with Drp-Containing Dna
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Human Exog Complexed with Drp-Containing Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg401
b:97.7
occ:1.00
|
NH2
|
D:ARG291
|
1.9
|
74.4
|
1.0
|
NE
|
D:ARG291
|
1.9
|
70.6
|
1.0
|
N
|
D:ASN292
|
1.9
|
77.5
|
1.0
|
CZ
|
D:ARG291
|
2.2
|
75.0
|
1.0
|
CB
|
D:ARG291
|
2.6
|
59.5
|
1.0
|
C
|
D:ARG291
|
2.7
|
48.1
|
1.0
|
CA
|
D:ARG291
|
2.7
|
57.8
|
1.0
|
O
|
D:HOH560
|
3.0
|
51.9
|
1.0
|
CA
|
D:ASN292
|
3.0
|
42.8
|
1.0
|
O
|
D:ASN292
|
3.0
|
48.3
|
1.0
|
CD
|
D:ARG291
|
3.2
|
70.1
|
1.0
|
C
|
D:ASN292
|
3.4
|
49.3
|
1.0
|
NH1
|
D:ARG291
|
3.4
|
62.2
|
1.0
|
CB
|
D:ASN292
|
3.5
|
50.8
|
1.0
|
CG
|
D:ARG291
|
3.5
|
55.7
|
1.0
|
O
|
D:ARG291
|
3.8
|
48.5
|
1.0
|
CB
|
D:SER295
|
3.9
|
54.9
|
1.0
|
N
|
D:VAL296
|
4.1
|
43.6
|
1.0
|
N
|
D:ARG291
|
4.2
|
46.5
|
1.0
|
CB
|
D:VAL296
|
4.3
|
48.6
|
1.0
|
OG
|
D:SER295
|
4.6
|
63.3
|
1.0
|
N
|
D:ILE293
|
4.6
|
37.4
|
1.0
|
CG1
|
D:VAL296
|
4.7
|
50.0
|
1.0
|
CA
|
D:SER295
|
4.8
|
48.3
|
1.0
|
C
|
D:SER295
|
4.8
|
45.0
|
1.0
|
CA
|
D:VAL296
|
4.8
|
50.4
|
1.0
|
CG
|
D:ASN292
|
4.9
|
41.2
|
1.0
|
O
|
D:ILE290
|
5.0
|
54.9
|
1.0
|
N
|
D:SER295
|
5.0
|
47.8
|
1.0
|
|
Magnesium binding site 2 out
of 6 in 7r6v
Go back to
Magnesium Binding Sites List in 7r6v
Magnesium binding site 2 out
of 6 in the Human Exog Complexed with Drp-Containing Dna
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Human Exog Complexed with Drp-Containing Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Mg101
b:30.4
occ:1.00
|
ND2
|
D:ASN171
|
1.9
|
27.0
|
1.0
|
O
|
F:HOH203
|
2.1
|
28.7
|
1.0
|
O
|
D:HOH528
|
2.1
|
27.5
|
1.0
|
O3'
|
F:DT2
|
2.3
|
32.8
|
1.0
|
OP1
|
F:DG3
|
2.4
|
25.4
|
1.0
|
P
|
F:DG3
|
2.8
|
32.4
|
1.0
|
CG
|
D:ASN171
|
3.2
|
33.1
|
1.0
|
O5'
|
F:DG3
|
3.3
|
27.8
|
1.0
|
C3'
|
F:DT2
|
3.4
|
28.2
|
1.0
|
O
|
D:ASN171
|
3.6
|
20.8
|
1.0
|
C2'
|
F:DT2
|
3.8
|
32.7
|
1.0
|
C4'
|
F:DT2
|
3.8
|
31.8
|
1.0
|
CA
|
D:ASN171
|
3.9
|
28.4
|
1.0
|
OE1
|
D:GLN166
|
3.9
|
25.1
|
1.0
|
CB
|
D:ASN171
|
4.0
|
27.0
|
1.0
|
OD1
|
D:ASN171
|
4.0
|
50.8
|
1.0
|
C
|
D:ASN171
|
4.0
|
27.4
|
1.0
|
OP2
|
F:DG3
|
4.2
|
30.6
|
1.0
|
N
|
D:HIS140
|
4.4
|
26.5
|
1.0
|
OE1
|
D:GLU179
|
4.4
|
27.4
|
1.0
|
CA
|
D:GLY139
|
4.4
|
27.6
|
1.0
|
CD
|
D:GLN166
|
4.5
|
24.9
|
1.0
|
CD1
|
D:TRP175
|
4.6
|
24.6
|
1.0
|
OE2
|
D:GLU179
|
4.6
|
33.8
|
1.0
|
C5'
|
F:DT2
|
4.7
|
26.8
|
1.0
|
C5'
|
F:DG3
|
4.7
|
28.5
|
1.0
|
O
|
D:HIS140
|
4.7
|
30.3
|
1.0
|
NE2
|
D:GLN166
|
4.7
|
24.5
|
1.0
|
O
|
F:HOH206
|
4.8
|
35.8
|
1.0
|
C
|
D:GLY139
|
4.9
|
25.1
|
1.0
|
CD
|
D:GLU179
|
4.9
|
33.8
|
1.0
|
C1'
|
F:DT2
|
5.0
|
33.6
|
1.0
|
O4'
|
F:DT2
|
5.0
|
28.0
|
1.0
|
|
Magnesium binding site 3 out
of 6 in 7r6v
Go back to
Magnesium Binding Sites List in 7r6v
Magnesium binding site 3 out
of 6 in the Human Exog Complexed with Drp-Containing Dna
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Human Exog Complexed with Drp-Containing Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Mg101
b:30.1
occ:1.00
|
ND2
|
E:ASN171
|
1.9
|
41.6
|
1.0
|
OD1
|
E:ASN171
|
2.0
|
55.0
|
1.0
|
CG
|
E:ASN171
|
2.2
|
28.1
|
1.0
|
OP1
|
H:DG3
|
2.2
|
31.0
|
1.0
|
O3'
|
H:DT2
|
2.3
|
36.1
|
1.0
|
O
|
E:HOH410
|
2.4
|
25.1
|
1.0
|
O
|
E:HOH418
|
2.4
|
28.0
|
1.0
|
O
|
E:HOH428
|
2.4
|
29.3
|
1.0
|
P
|
H:DG3
|
2.8
|
30.9
|
1.0
|
O5'
|
H:DG3
|
3.4
|
34.9
|
1.0
|
CB
|
E:ASN171
|
3.6
|
29.5
|
1.0
|
C3'
|
H:DT2
|
3.6
|
34.8
|
1.0
|
N
|
E:HIS140
|
4.0
|
24.2
|
1.0
|
O
|
E:ASN171
|
4.0
|
29.2
|
1.0
|
OE1
|
E:GLN166
|
4.0
|
30.9
|
1.0
|
C4'
|
H:DT2
|
4.1
|
35.0
|
1.0
|
OP2
|
H:DG3
|
4.1
|
34.1
|
1.0
|
CA
|
E:ASN171
|
4.2
|
33.9
|
1.0
|
CA
|
E:GLY139
|
4.2
|
26.0
|
1.0
|
C2'
|
H:DT2
|
4.2
|
32.8
|
1.0
|
O
|
E:HIS140
|
4.3
|
32.0
|
1.0
|
OE2
|
E:GLU179
|
4.4
|
33.7
|
1.0
|
C
|
E:ASN171
|
4.4
|
32.1
|
1.0
|
OE1
|
E:GLU179
|
4.4
|
29.2
|
1.0
|
CD1
|
E:TRP175
|
4.5
|
27.6
|
1.0
|
C
|
E:GLY139
|
4.5
|
29.4
|
1.0
|
O
|
H:HOH206
|
4.6
|
32.4
|
1.0
|
CD
|
E:GLN166
|
4.7
|
34.1
|
1.0
|
C5'
|
H:DT2
|
4.7
|
29.7
|
1.0
|
C5'
|
H:DG3
|
4.8
|
36.8
|
1.0
|
CD
|
E:GLU179
|
4.8
|
32.9
|
1.0
|
NE2
|
E:GLN166
|
4.9
|
30.7
|
1.0
|
CA
|
E:HIS140
|
4.9
|
27.3
|
1.0
|
O
|
E:ARG138
|
4.9
|
30.9
|
1.0
|
CB
|
E:HIS140
|
5.0
|
25.1
|
1.0
|
|
Magnesium binding site 4 out
of 6 in 7r6v
Go back to
Magnesium Binding Sites List in 7r6v
Magnesium binding site 4 out
of 6 in the Human Exog Complexed with Drp-Containing Dna
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Human Exog Complexed with Drp-Containing Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Mg401
b:31.8
occ:1.00
|
ND2
|
I:ASN171
|
1.9
|
31.7
|
1.0
|
O
|
K:HOH101
|
2.2
|
27.1
|
1.0
|
OP1
|
K:DG3
|
2.4
|
27.5
|
1.0
|
O3'
|
K:DT2
|
2.4
|
34.2
|
1.0
|
O
|
I:HOH538
|
2.4
|
26.5
|
1.0
|
CB
|
I:ASN171
|
2.5
|
36.8
|
1.0
|
CG
|
I:ASN171
|
2.5
|
35.4
|
1.0
|
P
|
K:DG3
|
2.8
|
33.5
|
1.0
|
O
|
I:HOH506
|
2.9
|
43.8
|
1.0
|
O5'
|
K:DG3
|
3.0
|
33.2
|
1.0
|
O
|
I:ASN171
|
3.5
|
31.9
|
1.0
|
C3'
|
K:DT2
|
3.6
|
34.5
|
1.0
|
CA
|
I:ASN171
|
3.7
|
36.3
|
1.0
|
OD1
|
I:ASN171
|
3.7
|
43.1
|
1.0
|
C
|
I:ASN171
|
3.8
|
31.3
|
1.0
|
OE1
|
I:GLN166
|
3.8
|
30.9
|
1.0
|
C2'
|
K:DT2
|
3.9
|
37.6
|
1.0
|
C4'
|
K:DT2
|
4.1
|
32.8
|
1.0
|
CA
|
I:GLY139
|
4.1
|
26.3
|
1.0
|
OP2
|
K:DG3
|
4.3
|
38.2
|
1.0
|
N
|
I:HIS140
|
4.4
|
27.3
|
1.0
|
C5'
|
K:DG3
|
4.5
|
34.4
|
1.0
|
CD
|
I:GLN166
|
4.5
|
36.4
|
1.0
|
O
|
I:ARG138
|
4.7
|
27.6
|
1.0
|
N
|
I:SER172
|
4.7
|
28.5
|
1.0
|
C
|
I:GLY139
|
4.7
|
26.5
|
1.0
|
CD1
|
I:TRP175
|
4.8
|
28.4
|
1.0
|
N
|
I:ASN171
|
4.9
|
29.5
|
1.0
|
NE2
|
I:GLN166
|
4.9
|
31.7
|
1.0
|
O
|
I:HIS140
|
4.9
|
30.6
|
1.0
|
OE1
|
I:GLU179
|
5.0
|
28.5
|
1.0
|
|
Magnesium binding site 5 out
of 6 in 7r6v
Go back to
Magnesium Binding Sites List in 7r6v
Magnesium binding site 5 out
of 6 in the Human Exog Complexed with Drp-Containing Dna
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Human Exog Complexed with Drp-Containing Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Mg402
b:71.0
occ:1.00
|
N
|
I:GLY71
|
1.9
|
37.7
|
1.0
|
CA
|
I:GLY71
|
2.4
|
33.0
|
1.0
|
OE1
|
I:GLU73
|
2.4
|
43.8
|
1.0
|
C
|
I:THR70
|
3.1
|
37.3
|
1.0
|
C
|
I:GLY71
|
3.3
|
36.1
|
1.0
|
N
|
I:THR72
|
3.3
|
33.8
|
1.0
|
N
|
I:THR70
|
3.4
|
36.9
|
1.0
|
CD
|
I:GLU73
|
3.5
|
50.7
|
1.0
|
OG1
|
I:THR70
|
3.6
|
40.0
|
1.0
|
CA
|
I:THR70
|
3.7
|
36.7
|
1.0
|
OE2
|
I:GLU73
|
3.8
|
58.9
|
1.0
|
O
|
I:THR70
|
4.1
|
32.2
|
1.0
|
C
|
I:LEU69
|
4.2
|
31.0
|
1.0
|
CB
|
I:THR70
|
4.3
|
40.8
|
1.0
|
O
|
I:GLY71
|
4.4
|
30.6
|
1.0
|
CB
|
I:LEU69
|
4.5
|
31.5
|
1.0
|
N
|
I:GLU73
|
4.5
|
36.0
|
1.0
|
CA
|
I:LEU69
|
4.5
|
29.8
|
1.0
|
CA
|
I:THR72
|
4.6
|
32.8
|
1.0
|
CG
|
I:GLU73
|
4.8
|
46.8
|
1.0
|
OG1
|
I:THR72
|
4.9
|
38.9
|
1.0
|
CD2
|
I:LEU69
|
5.0
|
38.6
|
1.0
|
|
Magnesium binding site 6 out
of 6 in 7r6v
Go back to
Magnesium Binding Sites List in 7r6v
Magnesium binding site 6 out
of 6 in the Human Exog Complexed with Drp-Containing Dna
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of Human Exog Complexed with Drp-Containing Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Mg101
b:33.2
occ:1.00
|
ND2
|
G:ASN171
|
1.9
|
39.5
|
1.0
|
OD1
|
G:ASN171
|
2.0
|
53.3
|
1.0
|
OP1
|
J:DG3
|
2.0
|
30.6
|
1.0
|
O3'
|
J:DT2
|
2.1
|
35.7
|
1.0
|
CG
|
G:ASN171
|
2.2
|
35.1
|
1.0
|
P
|
J:DG3
|
2.5
|
27.3
|
1.0
|
O
|
G:HOH514
|
2.6
|
28.7
|
1.0
|
O
|
G:HOH503
|
2.6
|
32.6
|
1.0
|
O
|
G:HOH518
|
2.7
|
31.0
|
1.0
|
O5'
|
J:DG3
|
3.1
|
30.4
|
1.0
|
C3'
|
J:DT2
|
3.4
|
36.6
|
1.0
|
CB
|
G:ASN171
|
3.7
|
29.9
|
1.0
|
N
|
G:HIS140
|
3.9
|
24.6
|
1.0
|
OP2
|
J:DG3
|
3.9
|
35.1
|
1.0
|
C4'
|
J:DT2
|
3.9
|
36.0
|
1.0
|
C2'
|
J:DT2
|
4.0
|
37.1
|
1.0
|
O
|
G:ASN171
|
4.1
|
32.8
|
1.0
|
OE1
|
G:GLN166
|
4.2
|
31.5
|
1.0
|
CA
|
G:GLY139
|
4.2
|
27.1
|
1.0
|
O
|
J:HOH206
|
4.2
|
27.5
|
1.0
|
O
|
G:HIS140
|
4.3
|
31.5
|
1.0
|
CA
|
G:ASN171
|
4.5
|
36.2
|
1.0
|
C
|
G:GLY139
|
4.5
|
27.6
|
1.0
|
OE2
|
G:GLU179
|
4.5
|
33.6
|
1.0
|
C5'
|
J:DG3
|
4.5
|
30.6
|
1.0
|
C
|
G:ASN171
|
4.5
|
32.3
|
1.0
|
C5'
|
J:DT2
|
4.6
|
30.4
|
1.0
|
OE1
|
G:GLU179
|
4.7
|
34.4
|
1.0
|
O
|
G:ARG138
|
4.7
|
28.6
|
1.0
|
CA
|
G:HIS140
|
4.8
|
26.2
|
1.0
|
CB
|
G:HIS140
|
4.8
|
21.7
|
1.0
|
CD
|
G:GLN166
|
4.9
|
33.0
|
1.0
|
CD1
|
G:TRP175
|
4.9
|
30.4
|
1.0
|
|
Reference:
M.R.Szymanski,
Y.W.Yin.
Human Exog Possesses Strong Ap Hydrolysis Activity To Be Published.
Page generated: Thu Oct 3 07:29:10 2024
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