Magnesium in PDB 9chn: P. Vulgaris Trimeric Higba- Operator 2 Dna
Protein crystallography data
The structure of P. Vulgaris Trimeric Higba- Operator 2 Dna, PDB code: 9chn
was solved by
I.J.Pavelich,
M.A.Schureck,
E.D.Hoffer,
C.M.Dunham,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
34.98 /
2.80
|
Space group
|
I 41
|
Cell size a, b, c (Å), α, β, γ (°)
|
139.82,
139.82,
80.8,
90,
90,
90
|
R / Rfree (%)
|
17.4 /
21.8
|
Magnesium Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
12;
Binding sites:
The binding sites of Magnesium atom in the P. Vulgaris Trimeric Higba- Operator 2 Dna
(pdb code 9chn). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 12 binding sites of Magnesium where determined in the
P. Vulgaris Trimeric Higba- Operator 2 Dna, PDB code: 9chn:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Magnesium binding site 1 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 1 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg201
b:28.5
occ:1.00
|
O
|
A:LEU90
|
2.1
|
50.3
|
1.0
|
O
|
A:HOH307
|
2.1
|
36.4
|
1.0
|
O
|
A:HOH312
|
2.1
|
32.3
|
1.0
|
O
|
A:HOH306
|
2.1
|
31.2
|
1.0
|
O
|
A:GLY92
|
2.1
|
56.5
|
1.0
|
C
|
A:GLY92
|
3.2
|
46.2
|
1.0
|
C
|
A:LEU90
|
3.3
|
43.3
|
1.0
|
N
|
A:GLY92
|
3.4
|
46.7
|
1.0
|
C
|
A:TYR91
|
3.8
|
41.2
|
1.0
|
CA
|
A:GLY92
|
3.8
|
44.6
|
1.0
|
N
|
A:TYR91
|
4.2
|
44.4
|
1.0
|
CA
|
A:TYR91
|
4.2
|
39.6
|
1.0
|
CA
|
A:LEU90
|
4.4
|
39.1
|
1.0
|
N
|
A:GLU93
|
4.4
|
55.4
|
1.0
|
O
|
A:TYR91
|
4.4
|
53.3
|
1.0
|
CB
|
A:LEU90
|
4.4
|
40.5
|
1.0
|
O
|
A:HOH303
|
4.5
|
47.1
|
1.0
|
CG
|
A:LEU90
|
4.7
|
49.8
|
1.0
|
CG1
|
A:VAL89
|
4.7
|
40.6
|
1.0
|
N
|
A:LEU90
|
4.7
|
39.2
|
1.0
|
CA
|
A:GLU93
|
4.8
|
56.2
|
1.0
|
C
|
A:GLU93
|
5.0
|
67.2
|
1.0
|
|
Magnesium binding site 2 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 2 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg202
b:69.7
occ:1.00
|
O
|
A:HOH328
|
2.1
|
72.6
|
1.0
|
O
|
D:HOH209
|
2.1
|
68.5
|
1.0
|
O
|
D:HOH206
|
2.1
|
66.8
|
1.0
|
O
|
A:LYS45
|
2.1
|
70.2
|
1.0
|
O
|
A:HOH320
|
2.9
|
67.8
|
1.0
|
C
|
A:LYS45
|
3.2
|
31.3
|
1.0
|
OP2
|
D:DA13
|
3.6
|
50.2
|
1.0
|
N
|
A:THR46
|
4.1
|
33.0
|
1.0
|
CA
|
A:LYS45
|
4.1
|
39.7
|
1.0
|
CA
|
A:THR46
|
4.2
|
35.1
|
1.0
|
OP1
|
D:DA13
|
4.3
|
61.6
|
1.0
|
P
|
D:DA13
|
4.5
|
51.1
|
1.0
|
CG2
|
A:THR46
|
4.7
|
30.7
|
1.0
|
CB
|
A:LYS45
|
4.8
|
37.2
|
1.0
|
O
|
A:HOH317
|
4.8
|
48.2
|
1.0
|
|
Magnesium binding site 3 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 3 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg101
b:59.2
occ:1.00
|
O
|
B:ASP38
|
2.0
|
109.9
|
1.0
|
O
|
B:HOH202
|
2.1
|
57.3
|
1.0
|
O
|
C:HOH230
|
2.1
|
66.8
|
1.0
|
O
|
B:HOH205
|
2.1
|
62.8
|
1.0
|
O
|
B:HOH204
|
2.1
|
62.3
|
1.0
|
O
|
B:MET0
|
3.2
|
111.7
|
1.0
|
C
|
B:ASP38
|
3.3
|
82.4
|
1.0
|
C
|
B:MET0
|
3.6
|
116.1
|
1.0
|
O
|
B:HOH211
|
3.7
|
73.9
|
1.0
|
N
|
B:MET1
|
3.8
|
115.1
|
1.0
|
CA
|
B:MET1
|
3.8
|
112.5
|
1.0
|
OD2
|
B:ASP38
|
3.9
|
89.4
|
1.0
|
N
|
B:MET0
|
4.0
|
118.4
|
1.0
|
CA
|
B:THR39
|
4.1
|
64.0
|
1.0
|
N
|
B:THR39
|
4.1
|
65.1
|
1.0
|
CG
|
B:ASP38
|
4.2
|
90.7
|
1.0
|
CA
|
B:ASP38
|
4.3
|
76.7
|
1.0
|
CB
|
B:MET1
|
4.3
|
119.2
|
1.0
|
O
|
B:HOH201
|
4.4
|
67.5
|
1.0
|
O
|
B:THR39
|
4.4
|
70.7
|
1.0
|
CA
|
B:MET0
|
4.4
|
121.2
|
1.0
|
C
|
B:THR39
|
4.5
|
67.1
|
1.0
|
OD1
|
B:ASP38
|
4.6
|
99.8
|
1.0
|
OE1
|
C:GLU65
|
4.6
|
86.3
|
1.0
|
CB
|
B:ASP38
|
4.7
|
81.3
|
1.0
|
O
|
B:ALA40
|
4.9
|
86.8
|
1.0
|
|
Magnesium binding site 4 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 4 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg101
b:112.8
occ:1.00
|
O
|
D:HOH233
|
2.1
|
105.5
|
1.0
|
O
|
E:HOH204
|
2.1
|
113.9
|
1.0
|
O
|
D:HOH220
|
2.1
|
107.8
|
1.0
|
C5'
|
E:DT19
|
4.2
|
104.1
|
1.0
|
O4'
|
E:DT19
|
4.2
|
86.6
|
1.0
|
C4'
|
E:DT19
|
4.2
|
93.9
|
1.0
|
O
|
D:HOH211
|
4.4
|
63.2
|
1.0
|
O4'
|
D:DA6
|
4.5
|
72.5
|
1.0
|
N3
|
E:DA18
|
4.7
|
83.2
|
1.0
|
C4'
|
D:DA6
|
4.8
|
67.2
|
1.0
|
C5'
|
D:DA6
|
4.9
|
62.3
|
1.0
|
O2
|
D:DT5
|
4.9
|
56.0
|
1.0
|
|
Magnesium binding site 5 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 5 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg102
b:110.7
occ:1.00
|
O
|
E:HOH233
|
2.1
|
116.1
|
1.0
|
O
|
D:HOH240
|
2.1
|
101.0
|
1.0
|
O
|
D:HOH234
|
2.1
|
106.4
|
1.0
|
O
|
D:HOH227
|
2.1
|
107.6
|
1.0
|
O4'
|
D:DT14
|
4.1
|
52.5
|
1.0
|
C4'
|
D:DT14
|
4.4
|
49.4
|
1.0
|
C5'
|
E:DG11
|
4.6
|
82.0
|
1.0
|
N3
|
D:DA13
|
4.6
|
49.6
|
1.0
|
O
|
E:HOH213
|
4.7
|
67.2
|
1.0
|
O4'
|
E:DG11
|
4.7
|
76.0
|
1.0
|
C4'
|
E:DG11
|
4.8
|
76.0
|
1.0
|
C5'
|
D:DT14
|
4.8
|
44.7
|
1.0
|
O4'
|
E:DG10
|
4.8
|
69.6
|
1.0
|
N3
|
E:DG10
|
4.9
|
49.2
|
1.0
|
C2
|
D:DA13
|
4.9
|
45.0
|
1.0
|
|
Magnesium binding site 6 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 6 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg101
b:85.7
occ:1.00
|
O
|
D:HOH214
|
2.1
|
68.9
|
1.0
|
O
|
E:HOH244
|
2.1
|
85.2
|
1.0
|
O
|
E:HOH243
|
2.1
|
81.8
|
1.0
|
O
|
D:HOH239
|
2.1
|
93.5
|
1.0
|
O
|
E:HOH230
|
2.2
|
93.2
|
1.0
|
O
|
E:HOH246
|
2.4
|
71.6
|
1.0
|
N2
|
E:DG15
|
4.6
|
57.8
|
1.0
|
O
|
E:HOH232
|
4.6
|
62.1
|
1.0
|
O4'
|
E:DT16
|
4.7
|
59.1
|
1.0
|
C5'
|
D:DC9
|
4.7
|
79.8
|
1.0
|
N3
|
E:DG15
|
4.8
|
57.4
|
1.0
|
C4'
|
D:DC9
|
4.8
|
69.8
|
1.0
|
C4'
|
E:DT16
|
4.8
|
60.1
|
1.0
|
N3
|
D:DA8
|
4.9
|
66.0
|
1.0
|
O4'
|
D:DC9
|
4.9
|
66.2
|
1.0
|
C5'
|
E:DT16
|
5.0
|
56.9
|
1.0
|
|
Magnesium binding site 7 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 7 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 7 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg102
b:89.7
occ:1.00
|
O
|
D:HOH232
|
2.1
|
90.5
|
1.0
|
O
|
E:HOH220
|
2.1
|
82.2
|
1.0
|
O
|
E:HOH240
|
2.1
|
78.2
|
1.0
|
O
|
D:HOH218
|
2.1
|
92.0
|
1.0
|
N2
|
E:DG13
|
4.0
|
71.9
|
1.0
|
O4'
|
E:DT14
|
4.2
|
44.6
|
1.0
|
N3
|
E:DG13
|
4.4
|
45.9
|
1.0
|
C4'
|
E:DT14
|
4.6
|
43.6
|
1.0
|
N3
|
D:DA10
|
4.6
|
55.5
|
1.0
|
C2
|
E:DG13
|
4.7
|
53.7
|
1.0
|
C5'
|
E:DT14
|
4.9
|
42.4
|
1.0
|
|
Magnesium binding site 8 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 8 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 8 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg103
b:65.0
occ:1.00
|
O
|
E:HOH248
|
2.1
|
66.9
|
1.0
|
O
|
E:HOH239
|
2.1
|
65.1
|
1.0
|
C4'
|
E:DA20
|
4.4
|
105.9
|
1.0
|
C5'
|
E:DA20
|
4.7
|
112.0
|
1.0
|
O
|
E:HOH242
|
4.8
|
51.4
|
1.0
|
O3'
|
E:DA20
|
4.9
|
98.5
|
1.0
|
|
Magnesium binding site 9 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 9 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 9 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg104
b:90.7
occ:1.00
|
O
|
E:HOH235
|
2.1
|
93.1
|
1.0
|
O
|
E:HOH221
|
2.1
|
81.4
|
1.0
|
O
|
D:HOH242
|
2.1
|
87.4
|
1.0
|
O
|
D:HOH231
|
2.1
|
100.8
|
1.0
|
O
|
D:HOH213
|
2.1
|
88.3
|
1.0
|
O
|
D:HOH241
|
2.3
|
94.5
|
1.0
|
O
|
E:HOH247
|
2.8
|
87.6
|
1.0
|
O
|
D:HOH216
|
4.2
|
61.0
|
1.0
|
N2
|
D:DG15
|
4.3
|
47.6
|
1.0
|
N3
|
D:DG15
|
4.4
|
50.1
|
1.0
|
C4'
|
E:DT9
|
4.6
|
65.0
|
1.0
|
N3
|
E:DA8
|
4.6
|
57.2
|
1.0
|
C5'
|
E:DT9
|
4.7
|
69.3
|
1.0
|
O4'
|
E:DT9
|
4.8
|
59.9
|
1.0
|
C2
|
D:DG15
|
4.8
|
46.5
|
1.0
|
O4'
|
D:DT16
|
4.8
|
49.6
|
1.0
|
C2
|
E:DA8
|
5.0
|
52.2
|
1.0
|
|
Magnesium binding site 10 out
of 12 in 9chn
Go back to
Magnesium Binding Sites List in 9chn
Magnesium binding site 10 out
of 12 in the P. Vulgaris Trimeric Higba- Operator 2 Dna
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 10 of P. Vulgaris Trimeric Higba- Operator 2 Dna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg105
b:60.9
occ:1.00
|
O
|
E:HOH222
|
2.1
|
48.6
|
1.0
|
O
|
E:HOH234
|
2.1
|
60.0
|
1.0
|
O
|
D:HOH229
|
2.1
|
49.5
|
1.0
|
O
|
D:HOH238
|
2.1
|
54.7
|
1.0
|
O
|
E:HOH238
|
2.1
|
61.7
|
1.0
|
O
|
D:HOH212
|
2.1
|
63.0
|
1.0
|
O
|
D:HOH223
|
4.4
|
74.0
|
1.0
|
O4'
|
E:DT5
|
4.5
|
36.7
|
1.0
|
O4'
|
D:DT19
|
4.6
|
44.7
|
1.0
|
C4'
|
E:DT5
|
4.6
|
36.2
|
1.0
|
C4'
|
D:DT19
|
4.7
|
40.2
|
1.0
|
O4'
|
E:DA6
|
4.7
|
51.6
|
1.0
|
N3
|
D:DA18
|
4.9
|
46.9
|
1.0
|
O2
|
E:DT5
|
4.9
|
40.9
|
1.0
|
C5'
|
E:DA6
|
4.9
|
42.0
|
1.0
|
|
Reference:
I.J.Pavelich,
M.A.Schureck,
E.D.Hoffer,
C.M.Dunham.
P. Vulgaris Trimeric Higba- Operator 2 Dna To Be Published.
Page generated: Sat Aug 16 00:13:27 2025
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