Fluorine in PDB 8q0c: Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
Enzymatic activity of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
All present enzymatic activity of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine:
4.2.1.1;
4.2.1.69;
Protein crystallography data
The structure of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine, PDB code: 8q0c
was solved by
L.B.T.Pham,
A.Costantino,
L.Barbieri,
V.Calderone,
E.Luchinat,
L.Banci,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
|
Resolution Low / High (Å)
|
23.01 /
1.30
|
|
Space group
|
P 1 21 1
|
|
Cell size a, b, c (Å), α, β, γ (°)
|
41.99,
41.14,
71.21,
90,
104.2,
90
|
|
R / Rfree (%)
|
16.5 /
19.7
|
Other elements in 8q0c:
The structure of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine also contains other interesting chemical elements:
Fluorine Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
11;
Binding sites:
The binding sites of Fluorine atom in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
(pdb code 8q0c). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 11 binding sites of Fluorine where determined in the
Human Carbonic Anhydrase II Containing 3-Fluorotyrosine, PDB code: 8q0c:
Jump to Fluorine binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Fluorine binding site 1 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 1 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 1 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F7
b:12.7
occ:0.49
|
F
|
A:YOF7
|
0.0
|
12.7
|
0.5
|
|
CE1
|
A:YOF7
|
1.3
|
13.1
|
1.0
|
|
CZ
|
A:YOF7
|
2.3
|
11.6
|
1.0
|
|
CD1
|
A:YOF7
|
2.4
|
14.1
|
1.0
|
|
OH
|
A:YOF7
|
2.7
|
11.2
|
1.0
|
|
CB
|
A:HIS64
|
3.0
|
17.7
|
1.0
|
|
O
|
A:HOH545
|
3.2
|
15.4
|
1.0
|
|
CA
|
A:HIS64
|
3.4
|
16.8
|
1.0
|
|
O
|
A:HIS64
|
3.4
|
19.3
|
1.0
|
|
CZ3
|
A:TRP5
|
3.5
|
14.9
|
1.0
|
|
ND1
|
A:HIS64
|
3.5
|
23.5
|
1.0
|
|
O
|
A:HOH486
|
3.6
|
20.4
|
1.0
|
|
CE2
|
A:YOF7
|
3.6
|
11.1
|
1.0
|
|
CG
|
A:YOF7
|
3.7
|
11.0
|
1.0
|
|
CG
|
A:HIS64
|
3.7
|
21.3
|
1.0
|
|
C
|
A:HIS64
|
3.8
|
16.2
|
1.0
|
|
CH2
|
A:TRP5
|
3.9
|
14.3
|
1.0
|
|
CB
|
A:ASN244
|
4.0
|
10.0
|
1.0
|
|
CD2
|
A:YOF7
|
4.1
|
10.4
|
1.0
|
|
CE1
|
A:PHE231
|
4.4
|
15.9
|
1.0
|
|
CA
|
A:ASN244
|
4.5
|
9.2
|
1.0
|
|
CE3
|
A:TRP5
|
4.6
|
13.9
|
1.0
|
|
O
|
A:ASN244
|
4.6
|
10.1
|
1.0
|
|
CE1
|
A:HIS64
|
4.8
|
23.0
|
1.0
|
|
N
|
A:HIS64
|
4.8
|
16.7
|
1.0
|
|
C
|
A:ASN244
|
4.9
|
9.5
|
1.0
|
|
CB
|
A:YOF7
|
4.9
|
13.6
|
1.0
|
|
O
|
A:HOH597
|
5.0
|
28.4
|
1.0
|
|
N
|
A:ALA65
|
5.0
|
14.9
|
1.0
|
|
C
|
A:GLY6
|
5.0
|
16.5
|
1.0
|
|
CD2
|
A:HIS64
|
5.0
|
21.9
|
1.0
|
|
Fluorine binding site 2 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 2 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 2 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F40
b:26.4
occ:0.10
|
F
|
A:YOF40
|
0.0
|
26.4
|
0.1
|
|
CE1
|
A:YOF40
|
1.4
|
26.8
|
1.0
|
|
O
|
A:SER259
|
2.2
|
20.6
|
1.0
|
|
CZ
|
A:YOF40
|
2.4
|
28.2
|
1.0
|
|
CD1
|
A:YOF40
|
2.4
|
25.5
|
1.0
|
|
OH
|
A:YOF40
|
2.8
|
29.7
|
1.0
|
|
C
|
A:SER259
|
2.8
|
18.6
|
1.0
|
|
N
|
A:PHE260
|
3.3
|
20.2
|
1.0
|
|
CA
|
A:PHE260
|
3.5
|
23.4
|
1.0
|
|
CE2
|
A:YOF40
|
3.7
|
27.8
|
1.0
|
|
CG
|
A:YOF40
|
3.7
|
24.5
|
1.0
|
|
CA
|
A:SER259
|
3.9
|
16.9
|
1.0
|
|
O
|
A:HOH586
|
4.1
|
32.8
|
1.0
|
|
C
|
A:PHE260
|
4.1
|
28.3
|
1.0
|
|
CD2
|
A:YOF40
|
4.1
|
26.9
|
1.0
|
|
O
|
A:ASP41
|
4.2
|
25.9
|
1.0
|
|
O
|
A:ALA258
|
4.5
|
17.0
|
1.0
|
|
CA
|
A:PRO42
|
4.6
|
31.4
|
1.0
|
|
N
|
A:LYS261
|
4.6
|
32.5
|
1.0
|
|
C
|
A:ASP41
|
4.6
|
26.0
|
1.0
|
|
O
|
A:PHE260
|
4.6
|
29.5
|
1.0
|
|
N
|
A:PRO42
|
4.8
|
28.9
|
1.0
|
|
CB
|
A:SER259
|
4.8
|
16.2
|
1.0
|
|
N
|
A:ASP41
|
4.9
|
20.8
|
1.0
|
|
N
|
A:SER259
|
4.9
|
16.4
|
1.0
|
|
CB
|
A:PHE260
|
4.9
|
22.1
|
1.0
|
|
CB
|
A:YOF40
|
4.9
|
22.5
|
1.0
|
|
Fluorine binding site 3 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 3 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 3 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F51
b:13.3
occ:0.56
|
F
|
A:YOF51
|
0.0
|
13.3
|
0.6
|
|
CE1
|
A:YOF51
|
1.3
|
12.5
|
1.0
|
|
CZ
|
A:YOF51
|
2.4
|
11.3
|
1.0
|
|
CD1
|
A:YOF51
|
2.4
|
15.8
|
1.0
|
|
OH
|
A:YOF51
|
2.8
|
12.6
|
1.0
|
|
NE2
|
A:HIS122
|
3.0
|
9.4
|
1.0
|
|
CD2
|
A:HIS122
|
3.3
|
9.5
|
1.0
|
|
CE2
|
A:YOF51
|
3.7
|
13.0
|
1.0
|
|
CG
|
A:YOF51
|
3.7
|
14.4
|
1.0
|
|
C
|
A:ALA77
|
3.7
|
14.5
|
1.0
|
|
O
|
A:ALA77
|
3.7
|
16.4
|
1.0
|
|
N
|
A:VAL78
|
3.8
|
15.1
|
1.0
|
|
C
|
A:VAL78
|
3.8
|
13.8
|
1.0
|
|
CB
|
A:LEU90
|
3.9
|
10.3
|
1.0
|
|
O
|
A:VAL78
|
3.9
|
14.4
|
1.0
|
|
CA
|
A:VAL78
|
4.1
|
15.6
|
1.0
|
|
CD2
|
A:YOF51
|
4.1
|
14.2
|
1.0
|
|
N
|
A:LEU79
|
4.2
|
12.6
|
1.0
|
|
CB
|
A:ALA77
|
4.2
|
18.5
|
1.0
|
|
CE1
|
A:HIS122
|
4.3
|
9.0
|
1.0
|
|
CA
|
A:ALA77
|
4.4
|
17.4
|
1.0
|
|
CD2
|
A:LEU90
|
4.4
|
11.4
|
1.0
|
|
CG1
|
A:VAL49
|
4.4
|
18.3
|
1.0
|
|
CG
|
A:LEU90
|
4.5
|
10.7
|
1.0
|
|
CB
|
A:LEU79
|
4.6
|
14.1
|
1.0
|
|
CD1
|
A:LEU90
|
4.6
|
11.8
|
1.0
|
|
O
|
A:SER50
|
4.6
|
16.1
|
1.0
|
|
CG
|
A:HIS122
|
4.7
|
8.0
|
1.0
|
|
N
|
A:LEU90
|
4.7
|
10.2
|
1.0
|
|
CA
|
A:LEU90
|
4.8
|
9.3
|
1.0
|
|
CA
|
A:LEU79
|
4.8
|
12.1
|
1.0
|
|
N
|
A:SER50
|
4.9
|
18.1
|
1.0
|
|
CB
|
A:YOF51
|
4.9
|
14.8
|
1.0
|
|
C
|
A:SER50
|
4.9
|
16.9
|
1.0
|
|
Fluorine binding site 4 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 4 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 4 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F88
b:10.8
occ:0.43
|
F
|
A:YOF88
|
0.0
|
10.8
|
0.4
|
|
CE1
|
A:YOF88
|
1.3
|
12.2
|
1.0
|
|
CD1
|
A:YOF88
|
2.4
|
10.9
|
1.0
|
|
CZ
|
A:YOF88
|
2.4
|
11.3
|
1.0
|
|
OH
|
A:YOF88
|
2.8
|
12.0
|
1.0
|
|
N
|
A:GLY86
|
3.0
|
24.5
|
1.0
|
|
O
|
A:HOH490
|
3.1
|
16.7
|
1.0
|
|
CB
|
A:LEU84
|
3.3
|
13.7
|
1.0
|
|
N
|
A:ASP85
|
3.5
|
17.7
|
1.0
|
|
O
|
A:GLY86
|
3.5
|
23.1
|
1.0
|
|
C
|
A:GLY86
|
3.6
|
21.9
|
1.0
|
|
CG
|
A:YOF88
|
3.6
|
10.4
|
1.0
|
|
CA
|
A:GLY86
|
3.6
|
23.2
|
1.0
|
|
CE2
|
A:YOF88
|
3.7
|
10.8
|
1.0
|
|
CA
|
A:LEU84
|
3.9
|
15.3
|
1.0
|
|
CD2
|
A:LEU84
|
3.9
|
13.6
|
1.0
|
|
C
|
A:LEU84
|
4.0
|
16.9
|
1.0
|
|
ND2
|
A:ASN124
|
4.0
|
11.3
|
1.0
|
|
CG
|
A:LEU84
|
4.1
|
12.3
|
1.0
|
|
O
|
A:HOH563
|
4.1
|
23.9
|
1.0
|
|
C
|
A:ASP85
|
4.1
|
24.8
|
1.0
|
|
CD2
|
A:YOF88
|
4.1
|
9.3
|
1.0
|
|
N
|
A:THR87
|
4.2
|
18.0
|
1.0
|
|
CA
|
A:ASP85
|
4.3
|
22.2
|
1.0
|
|
CG
|
A:ASN124
|
4.5
|
10.2
|
1.0
|
|
CD1
|
A:LEU84
|
4.5
|
12.8
|
1.0
|
|
C
|
A:THR87
|
4.7
|
12.9
|
1.0
|
|
OD1
|
A:ASN124
|
4.8
|
11.3
|
1.0
|
|
O
|
A:THR87
|
4.8
|
14.3
|
1.0
|
|
CA
|
A:THR87
|
4.8
|
15.7
|
1.0
|
|
CB
|
A:YOF88
|
4.9
|
11.0
|
1.0
|
|
N
|
A:YOF88
|
4.9
|
11.9
|
1.0
|
|
O
|
A:LEU84
|
5.0
|
18.6
|
1.0
|
|
Fluorine binding site 5 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 5 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 5 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F114
b:12.3
occ:0.21
|
F
|
A:YOF114
|
0.0
|
12.3
|
0.2
|
|
CE1
|
A:YOF114
|
1.4
|
12.9
|
1.0
|
|
CZ
|
A:YOF114
|
2.4
|
15.4
|
1.0
|
|
CD1
|
A:YOF114
|
2.4
|
12.1
|
1.0
|
|
OH
|
A:YOF114
|
2.7
|
20.5
|
1.0
|
|
CG2
|
A:VAL109
|
3.0
|
12.8
|
1.0
|
|
CB
|
A:VAL109
|
3.3
|
13.3
|
1.0
|
|
O
|
A:HOH485
|
3.6
|
21.0
|
1.0
|
|
CE2
|
A:YOF114
|
3.6
|
13.8
|
1.0
|
|
CG
|
A:YOF114
|
3.7
|
9.7
|
1.0
|
|
CD2
|
A:PHE147
|
3.7
|
9.3
|
1.0
|
|
CE2
|
A:PHE147
|
3.7
|
9.2
|
1.0
|
|
CD
|
A:LYS112
|
4.0
|
20.0
|
1.0
|
|
CZ
|
A:PHE147
|
4.0
|
9.5
|
1.0
|
|
CG
|
A:PHE147
|
4.1
|
8.8
|
1.0
|
|
CD2
|
A:YOF114
|
4.1
|
11.6
|
1.0
|
|
N
|
A:VAL109
|
4.3
|
11.7
|
1.0
|
|
CG1
|
A:VAL109
|
4.3
|
15.4
|
1.0
|
|
CD1
|
A:PHE147
|
4.3
|
9.1
|
1.0
|
|
O
|
A:LYS112
|
4.4
|
10.8
|
1.0
|
|
CE1
|
A:PHE147
|
4.4
|
9.7
|
1.0
|
|
CE
|
A:LYS112
|
4.4
|
22.6
|
1.0
|
|
CA
|
A:VAL109
|
4.4
|
11.9
|
1.0
|
|
CG
|
A:LYS112
|
4.6
|
16.3
|
1.0
|
|
CB
|
A:PHE147
|
4.8
|
8.2
|
1.0
|
|
CB
|
A:LYS112
|
4.8
|
14.0
|
1.0
|
|
CB
|
A:YOF114
|
4.9
|
9.5
|
1.0
|
|
Fluorine binding site 6 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 6 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 6 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F128
b:20.0
occ:0.43
|
F
|
A:YOF128
|
0.0
|
20.0
|
0.4
|
|
CE2
|
A:YOF128
|
1.2
|
12.5
|
0.6
|
|
CE1
|
A:YOF128
|
1.3
|
15.1
|
0.4
|
|
CZ
|
A:YOF128
|
2.1
|
13.7
|
0.6
|
|
CZ
|
A:YOF128
|
2.4
|
13.1
|
0.4
|
|
CD2
|
A:YOF128
|
2.4
|
12.4
|
0.6
|
|
CD1
|
A:YOF128
|
2.4
|
13.7
|
0.4
|
|
OD1
|
A:ASP139
|
2.4
|
12.8
|
1.0
|
|
OH
|
A:YOF128
|
2.5
|
14.0
|
0.6
|
|
O
|
A:ASP139
|
2.7
|
11.2
|
1.0
|
|
OH
|
A:YOF128
|
2.8
|
11.5
|
0.4
|
|
C
|
A:ASP139
|
3.0
|
10.4
|
1.0
|
|
CG
|
A:ASP139
|
3.1
|
14.5
|
1.0
|
|
CA
|
A:GLY140
|
3.3
|
9.7
|
1.0
|
|
N
|
A:GLY140
|
3.3
|
11.0
|
1.0
|
|
CE1
|
A:YOF128
|
3.4
|
15.1
|
0.6
|
|
ND2
|
A:ASN124
|
3.5
|
11.3
|
1.0
|
|
CG
|
A:YOF128
|
3.6
|
12.7
|
0.6
|
|
CE2
|
A:YOF128
|
3.6
|
12.9
|
0.4
|
|
CG
|
A:YOF128
|
3.7
|
13.1
|
0.4
|
|
CB
|
A:GLN137
|
3.7
|
13.2
|
1.0
|
|
OD2
|
A:ASP139
|
3.7
|
16.7
|
1.0
|
|
CB
|
A:ASN124
|
3.7
|
9.6
|
1.0
|
|
CG
|
A:ASN124
|
3.8
|
10.2
|
1.0
|
|
CA
|
A:ASP139
|
3.9
|
12.1
|
1.0
|
|
CB
|
A:ASP139
|
4.0
|
12.4
|
1.0
|
|
CD1
|
A:YOF128
|
4.0
|
15.3
|
0.6
|
|
CE
|
A:LYS127
|
4.1
|
25.6
|
1.0
|
|
CD2
|
A:YOF128
|
4.1
|
14.2
|
0.4
|
|
CG
|
A:GLN137
|
4.2
|
13.4
|
1.0
|
|
N
|
A:ASP139
|
4.2
|
11.7
|
1.0
|
|
C
|
A:GLY140
|
4.4
|
9.0
|
1.0
|
|
F
|
A:YOF128
|
4.5
|
19.3
|
0.6
|
|
CG
|
A:LYS127
|
4.8
|
20.4
|
1.0
|
|
O
|
A:GLY140
|
4.8
|
9.5
|
1.0
|
|
OD1
|
A:ASN124
|
4.8
|
11.3
|
1.0
|
|
CB
|
A:YOF128
|
4.9
|
13.0
|
1.0
|
|
O
|
A:HOH575
|
5.0
|
30.0
|
1.0
|
|
CD
|
A:LYS127
|
5.0
|
23.3
|
1.0
|
|
Fluorine binding site 7 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 7 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 7 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F128
b:19.3
occ:0.57
|
F
|
A:YOF128
|
0.0
|
19.3
|
0.6
|
|
CE2
|
A:YOF128
|
1.3
|
12.9
|
0.4
|
|
CE1
|
A:YOF128
|
1.4
|
15.1
|
0.6
|
|
CZ
|
A:YOF128
|
2.1
|
13.1
|
0.4
|
|
CZ
|
A:YOF128
|
2.4
|
13.7
|
0.6
|
|
CD1
|
A:YOF128
|
2.4
|
15.3
|
0.6
|
|
CD2
|
A:YOF128
|
2.4
|
14.2
|
0.4
|
|
OH
|
A:YOF128
|
2.4
|
11.5
|
0.4
|
|
OH
|
A:YOF128
|
2.8
|
14.0
|
0.6
|
|
CE1
|
A:YOF128
|
3.5
|
15.1
|
0.4
|
|
CG
|
A:YOF128
|
3.6
|
13.1
|
0.4
|
|
O
|
A:HOH591
|
3.7
|
31.5
|
1.0
|
|
CE2
|
A:YOF128
|
3.7
|
12.5
|
0.6
|
|
CG
|
A:YOF128
|
3.7
|
12.7
|
0.6
|
|
OE1
|
A:GLN137
|
3.9
|
21.3
|
1.0
|
|
CD1
|
A:YOF128
|
4.0
|
13.7
|
0.4
|
|
CD
|
A:GLN137
|
4.1
|
18.0
|
1.0
|
|
CD2
|
A:YOF128
|
4.1
|
12.4
|
0.6
|
|
CE
|
A:LYS127
|
4.2
|
25.6
|
1.0
|
|
CG
|
A:GLN137
|
4.2
|
13.4
|
1.0
|
|
F
|
A:YOF128
|
4.5
|
20.0
|
0.4
|
|
CG
|
A:LYS127
|
4.6
|
20.4
|
1.0
|
|
NE2
|
A:GLN137
|
4.8
|
19.1
|
1.0
|
|
CB
|
A:GLN137
|
4.8
|
13.2
|
1.0
|
|
CD
|
A:LYS127
|
4.9
|
23.3
|
1.0
|
|
CB
|
A:YOF128
|
4.9
|
13.0
|
1.0
|
|
O
|
A:HOH575
|
5.0
|
30.0
|
1.0
|
|
Fluorine binding site 8 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 8 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 8 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F191
b:20.1
occ:0.56
|
F
|
A:YOF191
|
0.0
|
20.1
|
0.6
|
|
CE2
|
A:YOF191
|
1.2
|
14.1
|
0.4
|
|
CE1
|
A:YOF191
|
1.3
|
16.8
|
0.6
|
|
CZ
|
A:YOF191
|
2.2
|
15.4
|
0.4
|
|
CZ
|
A:YOF191
|
2.4
|
16.4
|
0.6
|
|
CD2
|
A:YOF191
|
2.4
|
13.1
|
0.4
|
|
CD1
|
A:YOF191
|
2.4
|
14.9
|
0.6
|
|
OH
|
A:YOF191
|
2.4
|
14.6
|
0.4
|
|
OH
|
A:YOF191
|
2.8
|
17.8
|
0.6
|
|
CG2
|
A:THR193
|
2.9
|
11.5
|
1.0
|
|
CB
|
A:THR193
|
3.2
|
11.5
|
1.0
|
|
CD1
|
A:LEU44
|
3.4
|
29.1
|
1.0
|
|
CE1
|
A:YOF191
|
3.5
|
15.8
|
0.4
|
|
CD
|
A:PRO83
|
3.5
|
19.6
|
1.0
|
|
CG
|
A:YOF191
|
3.6
|
12.8
|
0.4
|
|
CE2
|
A:YOF191
|
3.6
|
14.5
|
0.6
|
|
CG
|
A:YOF191
|
3.6
|
12.9
|
0.6
|
|
CG
|
A:PRO83
|
3.8
|
19.4
|
1.0
|
|
CD2
|
A:LEU44
|
3.9
|
28.9
|
1.0
|
|
CD1
|
A:YOF191
|
4.0
|
14.1
|
0.4
|
|
OG1
|
A:THR193
|
4.1
|
10.9
|
1.0
|
|
CD2
|
A:YOF191
|
4.1
|
13.5
|
0.6
|
|
CB
|
A:PRO83
|
4.1
|
19.2
|
1.0
|
|
CG
|
A:LEU44
|
4.2
|
29.6
|
1.0
|
|
N
|
A:PRO83
|
4.2
|
19.4
|
1.0
|
|
N
|
A:THR193
|
4.4
|
9.2
|
1.0
|
|
CA
|
A:THR193
|
4.4
|
11.0
|
1.0
|
|
F
|
A:YOF191
|
4.6
|
18.2
|
0.4
|
|
CB
|
A:SER259
|
4.6
|
16.2
|
1.0
|
|
C
|
A:TRP192
|
4.6
|
10.5
|
1.0
|
|
CA
|
A:PRO83
|
4.8
|
18.1
|
1.0
|
|
CB
|
A:YOF191
|
4.9
|
13.3
|
1.0
|
|
O
|
A:YOF191
|
4.9
|
13.4
|
1.0
|
|
C
|
A:GLY82
|
4.9
|
19.0
|
1.0
|
|
O
|
A:TRP192
|
4.9
|
11.8
|
1.0
|
|
CA
|
A:GLY82
|
4.9
|
19.1
|
1.0
|
|
CB
|
A:LEU44
|
5.0
|
30.6
|
1.0
|
|
O
|
A:LYS257
|
5.0
|
14.7
|
1.0
|
|
Fluorine binding site 9 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 9 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 9 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F191
b:18.2
occ:0.44
|
F
|
A:YOF191
|
0.0
|
18.2
|
0.4
|
|
CE2
|
A:YOF191
|
1.2
|
14.5
|
0.6
|
|
CE1
|
A:YOF191
|
1.4
|
15.8
|
0.4
|
|
CZ
|
A:YOF191
|
2.2
|
16.4
|
0.6
|
|
CD2
|
A:YOF191
|
2.4
|
13.5
|
0.6
|
|
CD1
|
A:YOF191
|
2.4
|
14.1
|
0.4
|
|
CZ
|
A:YOF191
|
2.4
|
15.4
|
0.4
|
|
O
|
A:HOH403
|
2.4
|
27.8
|
1.0
|
|
OH
|
A:YOF191
|
2.5
|
17.8
|
0.6
|
|
OH
|
A:YOF191
|
2.9
|
14.6
|
0.4
|
|
O
|
A:HOH578
|
2.9
|
30.8
|
1.0
|
|
CB
|
A:LEU47
|
3.4
|
22.7
|
1.0
|
|
CE1
|
A:YOF191
|
3.5
|
16.8
|
0.6
|
|
N
|
A:LEU47
|
3.5
|
23.5
|
1.0
|
|
CG
|
A:YOF191
|
3.6
|
12.9
|
0.6
|
|
CE2
|
A:YOF191
|
3.7
|
14.1
|
0.4
|
|
CG
|
A:YOF191
|
3.7
|
12.8
|
0.4
|
|
CB
|
A:SER259
|
3.8
|
16.2
|
1.0
|
|
CA
|
A:LEU47
|
4.0
|
21.9
|
1.0
|
|
O
|
A:LYS45
|
4.0
|
29.7
|
1.0
|
|
O
|
A:LEU189
|
4.0
|
18.5
|
1.0
|
|
OG
|
A:SER259
|
4.1
|
14.8
|
1.0
|
|
CD1
|
A:YOF191
|
4.1
|
14.9
|
0.6
|
|
CD2
|
A:YOF191
|
4.2
|
13.1
|
0.4
|
|
O
|
A:HOH586
|
4.3
|
32.8
|
1.0
|
|
C
|
A:PRO46
|
4.4
|
24.9
|
1.0
|
|
CG
|
A:LEU47
|
4.4
|
21.9
|
1.0
|
|
O
|
A:HOH439
|
4.4
|
32.5
|
1.0
|
|
CA
|
A:GLY82
|
4.4
|
19.1
|
1.0
|
|
CD2
|
A:LEU47
|
4.5
|
23.2
|
1.0
|
|
CD1
|
A:LEU47
|
4.6
|
22.1
|
1.0
|
|
F
|
A:YOF191
|
4.6
|
20.1
|
0.6
|
|
CA
|
A:PRO46
|
4.6
|
28.1
|
1.0
|
|
CB
|
A:YOF191
|
4.9
|
13.3
|
1.0
|
|
Fluorine binding site 10 out
of 11 in 8q0c
Go back to
Fluorine Binding Sites List in 8q0c
Fluorine binding site 10 out
of 11 in the Human Carbonic Anhydrase II Containing 3-Fluorotyrosine
 Mono view
 Stereo pair view
|
|
A full contact list of Fluorine with other atoms in the F binding
site number 10 of Human Carbonic Anhydrase II Containing 3-Fluorotyrosine within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F194
b:13.6
occ:0.59
|
F
|
A:YOF194
|
0.0
|
13.6
|
0.6
|
|
CE2
|
A:YOF194
|
1.3
|
9.0
|
0.4
|
|
CE1
|
A:YOF194
|
1.3
|
10.8
|
0.6
|
|
CZ
|
A:YOF194
|
2.2
|
9.2
|
0.4
|
|
CZ
|
A:YOF194
|
2.4
|
9.8
|
0.6
|
|
CD2
|
A:YOF194
|
2.4
|
9.8
|
0.4
|
|
CD1
|
A:YOF194
|
2.4
|
10.5
|
0.6
|
|
OH
|
A:YOF194
|
2.5
|
8.3
|
0.4
|
|
NH1
|
A:ARG254
|
2.6
|
12.0
|
1.0
|
|
OG
|
A:SER29
|
2.7
|
9.6
|
1.0
|
|
OH
|
A:YOF194
|
2.8
|
9.4
|
0.6
|
|
CA
|
A:GLY196
|
3.2
|
9.9
|
1.0
|
|
O
|
A:PRO195
|
3.2
|
11.3
|
1.0
|
|
CE1
|
A:YOF194
|
3.6
|
10.8
|
0.4
|
|
O
|
A:GLN28
|
3.6
|
12.3
|
1.0
|
|
CG
|
A:YOF194
|
3.6
|
10.5
|
0.4
|
|
CE2
|
A:YOF194
|
3.6
|
9.9
|
0.6
|
|
CG
|
A:YOF194
|
3.7
|
10.5
|
0.6
|
|
CZ
|
A:ARG254
|
3.7
|
13.2
|
1.0
|
|
C
|
A:PRO195
|
3.7
|
10.6
|
1.0
|
|
N
|
A:GLY196
|
3.7
|
8.3
|
1.0
|
|
CB
|
A:SER29
|
3.9
|
10.0
|
1.0
|
|
CG1
|
A:VAL31
|
3.9
|
13.0
|
1.0
|
|
CD1
|
A:YOF194
|
4.1
|
10.5
|
0.4
|
|
CD1
|
A:TRP209
|
4.1
|
8.6
|
1.0
|
|
CD2
|
A:YOF194
|
4.1
|
9.7
|
0.6
|
|
CA
|
A:SER29
|
4.2
|
9.6
|
1.0
|
|
C
|
A:GLN28
|
4.2
|
10.4
|
1.0
|
|
NH2
|
A:ARG254
|
4.3
|
12.9
|
1.0
|
|
C
|
A:GLY196
|
4.4
|
9.3
|
1.0
|
|
N
|
A:SER29
|
4.5
|
10.3
|
1.0
|
|
CG2
|
A:VAL31
|
4.5
|
13.1
|
1.0
|
|
N
|
A:SER197
|
4.6
|
10.9
|
1.0
|
|
NE
|
A:ARG254
|
4.6
|
14.2
|
1.0
|
|
F
|
A:YOF194
|
4.7
|
13.3
|
0.4
|
|
O
|
A:ARG27
|
4.7
|
12.3
|
1.0
|
|
NE1
|
A:TRP209
|
4.7
|
9.8
|
1.0
|
|
CD
|
A:ARG254
|
4.8
|
14.4
|
1.0
|
|
CG
|
A:TRP209
|
4.9
|
8.6
|
1.0
|
|
CB
|
A:VAL31
|
4.9
|
12.6
|
1.0
|
|
CB
|
A:YOF194
|
4.9
|
11.5
|
1.0
|
|
O
|
A:YOF194
|
4.9
|
9.6
|
1.0
|
|
CA
|
A:PRO195
|
4.9
|
10.8
|
1.0
|
|
C
|
A:YOF194
|
4.9
|
10.7
|
1.0
|
|
N
|
A:PRO195
|
5.0
|
10.7
|
1.0
|
|
C
|
A:ARG27
|
5.0
|
13.0
|
1.0
|
|
Reference:
A.Costantino,
L.B.T.Pham,
L.Barbieri,
V.Calderone,
G.Ben-Nissan,
M.Sharon,
L.Banci,
E.Luchinat.
Controlling the Incorporation of Fluorinated Amino Acids in Human Cells and Its Structural Impact. Protein Sci. V. 33 E4910 2024.
ISSN: ESSN 1469-896X
PubMed: 38358125
DOI: 10.1002/PRO.4910
Page generated: Fri Aug 2 22:21:50 2024
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