Fluorine in PDB 7ty8: Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid
(pdb code 7ty8). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 6 binding sites of Fluorine where determined in the
Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid, PDB code: 7ty8:
Jump to Fluorine binding site number:
1;
2;
3;
4;
5;
6;
Fluorine binding site 1 out
of 6 in 7ty8
Go back to
Fluorine Binding Sites List in 7ty8
Fluorine binding site 1 out
of 6 in the Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 1 of Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F2204
b:153.3
occ:1.00
|
F3
|
A:NFL2204
|
0.0
|
153.3
|
1.0
|
C15
|
A:NFL2204
|
1.3
|
152.6
|
1.0
|
F2
|
A:NFL2204
|
2.1
|
149.4
|
1.0
|
F1
|
A:NFL2204
|
2.1
|
154.4
|
1.0
|
C9
|
A:NFL2204
|
2.3
|
152.8
|
1.0
|
C10
|
A:NFL2204
|
2.8
|
154.0
|
1.0
|
O
|
A:LEU677
|
3.2
|
76.0
|
1.0
|
CG
|
A:PRO860
|
3.3
|
105.1
|
1.0
|
CA
|
A:LEU677
|
3.4
|
77.6
|
1.0
|
C14
|
A:NFL2204
|
3.5
|
153.4
|
1.0
|
CB
|
A:PRO860
|
3.7
|
105.3
|
1.0
|
C
|
A:LEU677
|
3.8
|
74.2
|
1.0
|
CG
|
A:LEU677
|
3.9
|
83.9
|
1.0
|
CB
|
A:LEU677
|
4.0
|
80.5
|
1.0
|
C11
|
A:NFL2204
|
4.1
|
152.7
|
1.0
|
CA
|
A:PRO860
|
4.3
|
105.7
|
1.0
|
CB
|
A:LEU680
|
4.3
|
72.2
|
1.0
|
CD
|
A:PRO860
|
4.3
|
104.5
|
1.0
|
N
|
A:LEU677
|
4.4
|
77.4
|
1.0
|
O
|
A:ILE676
|
4.4
|
77.8
|
1.0
|
N
|
A:GLU681
|
4.5
|
70.8
|
1.0
|
N1
|
A:NFL2204
|
4.6
|
154.4
|
1.0
|
N
|
A:PRO860
|
4.6
|
104.8
|
1.0
|
C13
|
A:NFL2204
|
4.7
|
153.0
|
1.0
|
C
|
A:ILE676
|
4.8
|
75.7
|
1.0
|
CD1
|
A:LEU677
|
4.8
|
85.1
|
1.0
|
CB
|
A:GLU681
|
4.8
|
75.5
|
1.0
|
CD2
|
A:LEU677
|
4.8
|
86.8
|
1.0
|
C
|
A:LEU680
|
4.9
|
70.0
|
1.0
|
C12
|
A:NFL2204
|
4.9
|
151.6
|
1.0
|
CB
|
A:PRO467
|
4.9
|
75.0
|
1.0
|
|
Fluorine binding site 2 out
of 6 in 7ty8
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Fluorine Binding Sites List in 7ty8
Fluorine binding site 2 out
of 6 in the Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 2 of Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F2204
b:154.4
occ:1.00
|
F1
|
A:NFL2204
|
0.0
|
154.4
|
1.0
|
C15
|
A:NFL2204
|
1.3
|
152.6
|
1.0
|
F3
|
A:NFL2204
|
2.1
|
153.3
|
1.0
|
F2
|
A:NFL2204
|
2.1
|
149.4
|
1.0
|
C9
|
A:NFL2204
|
2.4
|
152.8
|
1.0
|
C10
|
A:NFL2204
|
3.1
|
154.0
|
1.0
|
C14
|
A:NFL2204
|
3.3
|
153.4
|
1.0
|
CD2
|
A:LEU863
|
3.3
|
90.0
|
1.0
|
CB
|
A:LEU680
|
3.4
|
72.2
|
1.0
|
CA
|
A:PRO860
|
3.8
|
105.7
|
1.0
|
CB
|
A:PRO860
|
3.9
|
105.3
|
1.0
|
C
|
A:LEU680
|
4.2
|
70.0
|
1.0
|
CG
|
A:PRO860
|
4.2
|
105.1
|
1.0
|
CD1
|
A:LEU680
|
4.2
|
72.5
|
1.0
|
N
|
A:GLU681
|
4.3
|
70.8
|
1.0
|
C11
|
A:NFL2204
|
4.4
|
152.7
|
1.0
|
O
|
A:LEU680
|
4.4
|
72.1
|
1.0
|
CA
|
A:LEU680
|
4.4
|
70.7
|
1.0
|
CG
|
A:LEU680
|
4.4
|
73.9
|
1.0
|
C13
|
A:NFL2204
|
4.5
|
153.0
|
1.0
|
N
|
A:PRO860
|
4.5
|
104.8
|
1.0
|
CG
|
A:LEU863
|
4.5
|
91.7
|
1.0
|
CE2
|
A:PHE524
|
4.6
|
59.6
|
1.0
|
O
|
A:LEU677
|
4.6
|
76.0
|
1.0
|
CB
|
A:LEU863
|
4.6
|
92.2
|
1.0
|
CD
|
A:PRO860
|
4.9
|
104.5
|
1.0
|
C12
|
A:NFL2204
|
4.9
|
151.6
|
1.0
|
CA
|
A:GLU681
|
4.9
|
70.6
|
1.0
|
CD2
|
A:PHE524
|
4.9
|
61.4
|
1.0
|
|
Fluorine binding site 3 out
of 6 in 7ty8
Go back to
Fluorine Binding Sites List in 7ty8
Fluorine binding site 3 out
of 6 in the Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 3 of Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F2204
b:149.4
occ:1.00
|
F2
|
A:NFL2204
|
0.0
|
149.4
|
1.0
|
C15
|
A:NFL2204
|
1.3
|
152.6
|
1.0
|
F3
|
A:NFL2204
|
2.1
|
153.3
|
1.0
|
F1
|
A:NFL2204
|
2.1
|
154.4
|
1.0
|
C9
|
A:NFL2204
|
2.4
|
152.8
|
1.0
|
N
|
A:GLU681
|
2.6
|
70.8
|
1.0
|
C14
|
A:NFL2204
|
2.8
|
153.4
|
1.0
|
O
|
A:LEU677
|
2.9
|
76.0
|
1.0
|
CA
|
A:GLU681
|
3.0
|
70.6
|
1.0
|
C
|
A:LEU680
|
3.1
|
70.0
|
1.0
|
CB
|
A:GLU681
|
3.2
|
75.5
|
1.0
|
CB
|
A:LEU680
|
3.6
|
72.2
|
1.0
|
C10
|
A:NFL2204
|
3.6
|
154.0
|
1.0
|
O
|
A:LEU680
|
3.6
|
72.1
|
1.0
|
CA
|
A:LEU680
|
3.8
|
70.7
|
1.0
|
C
|
A:LEU677
|
4.0
|
74.2
|
1.0
|
C13
|
A:NFL2204
|
4.1
|
153.0
|
1.0
|
CE2
|
A:PHE524
|
4.2
|
59.6
|
1.0
|
OE1
|
A:GLU681
|
4.2
|
87.4
|
1.0
|
CA
|
A:LEU677
|
4.3
|
77.6
|
1.0
|
N
|
A:LEU680
|
4.4
|
71.2
|
1.0
|
CG
|
A:GLU681
|
4.4
|
80.3
|
1.0
|
CD
|
A:GLU681
|
4.5
|
86.0
|
1.0
|
C
|
A:GLU681
|
4.5
|
64.7
|
1.0
|
O
|
A:ILE676
|
4.6
|
77.8
|
1.0
|
C11
|
A:NFL2204
|
4.7
|
152.7
|
1.0
|
CD2
|
A:LEU863
|
4.8
|
90.0
|
1.0
|
CZ
|
A:PHE524
|
4.9
|
59.1
|
1.0
|
C12
|
A:NFL2204
|
4.9
|
151.6
|
1.0
|
CG
|
A:LEU680
|
5.0
|
73.9
|
1.0
|
|
Fluorine binding site 4 out
of 6 in 7ty8
Go back to
Fluorine Binding Sites List in 7ty8
Fluorine binding site 4 out
of 6 in the Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 4 of Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:F2204
b:145.8
occ:1.00
|
F3
|
B:NFL2204
|
0.0
|
145.8
|
1.0
|
C15
|
B:NFL2204
|
1.3
|
145.3
|
1.0
|
F1
|
B:NFL2204
|
2.1
|
145.9
|
1.0
|
F2
|
B:NFL2204
|
2.1
|
142.1
|
1.0
|
C9
|
B:NFL2204
|
2.4
|
146.3
|
1.0
|
CD2
|
B:LEU863
|
3.1
|
90.0
|
1.0
|
C10
|
B:NFL2204
|
3.1
|
146.9
|
1.0
|
C14
|
B:NFL2204
|
3.3
|
147.3
|
1.0
|
CB
|
B:LEU680
|
3.9
|
72.3
|
1.0
|
CA
|
B:PRO860
|
4.0
|
106.2
|
1.0
|
CB
|
B:PRO860
|
4.2
|
105.9
|
1.0
|
CG
|
B:LEU863
|
4.4
|
91.7
|
1.0
|
CE2
|
B:PHE524
|
4.4
|
59.3
|
1.0
|
C11
|
B:NFL2204
|
4.4
|
145.6
|
1.0
|
CG
|
B:PRO860
|
4.4
|
105.7
|
1.0
|
CB
|
B:LEU863
|
4.4
|
92.2
|
1.0
|
N
|
B:PRO860
|
4.5
|
105.3
|
1.0
|
C13
|
B:NFL2204
|
4.5
|
146.7
|
1.0
|
C
|
B:LEU680
|
4.5
|
70.0
|
1.0
|
CD1
|
B:LEU680
|
4.6
|
72.7
|
1.0
|
O
|
B:LEU680
|
4.6
|
72.1
|
1.0
|
N
|
B:GLU681
|
4.6
|
70.8
|
1.0
|
CD2
|
B:PHE524
|
4.7
|
61.2
|
1.0
|
CA
|
B:LEU680
|
4.8
|
70.8
|
1.0
|
CG
|
B:LEU680
|
4.9
|
74.1
|
1.0
|
CD
|
B:PRO860
|
4.9
|
105.1
|
1.0
|
C12
|
B:NFL2204
|
4.9
|
145.5
|
1.0
|
O
|
B:LEU677
|
4.9
|
76.2
|
1.0
|
C
|
B:LEU859
|
5.0
|
105.0
|
1.0
|
|
Fluorine binding site 5 out
of 6 in 7ty8
Go back to
Fluorine Binding Sites List in 7ty8
Fluorine binding site 5 out
of 6 in the Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 5 of Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:F2204
b:145.9
occ:1.00
|
F1
|
B:NFL2204
|
0.0
|
145.9
|
1.0
|
C15
|
B:NFL2204
|
1.3
|
145.3
|
1.0
|
F2
|
B:NFL2204
|
2.1
|
142.1
|
1.0
|
F3
|
B:NFL2204
|
2.1
|
145.8
|
1.0
|
C9
|
B:NFL2204
|
2.4
|
146.3
|
1.0
|
C10
|
B:NFL2204
|
2.8
|
146.9
|
1.0
|
CG
|
B:PRO860
|
3.3
|
105.7
|
1.0
|
C14
|
B:NFL2204
|
3.5
|
147.3
|
1.0
|
O
|
B:LEU677
|
3.6
|
76.2
|
1.0
|
CB
|
B:PRO860
|
3.7
|
105.9
|
1.0
|
CA
|
B:LEU677
|
3.8
|
77.7
|
1.0
|
CG
|
B:LEU677
|
4.1
|
84.0
|
1.0
|
C11
|
B:NFL2204
|
4.2
|
145.6
|
1.0
|
CA
|
B:PRO860
|
4.2
|
106.2
|
1.0
|
CD
|
B:PRO860
|
4.2
|
105.1
|
1.0
|
C
|
B:LEU677
|
4.2
|
74.2
|
1.0
|
CB
|
B:LEU677
|
4.4
|
80.5
|
1.0
|
N
|
B:PRO860
|
4.4
|
105.3
|
1.0
|
CB
|
B:LEU680
|
4.5
|
72.3
|
1.0
|
C13
|
B:NFL2204
|
4.7
|
146.7
|
1.0
|
N1
|
B:NFL2204
|
4.7
|
146.7
|
1.0
|
N
|
B:GLU681
|
4.7
|
70.8
|
1.0
|
N
|
B:LEU677
|
4.8
|
77.4
|
1.0
|
CB
|
B:PRO467
|
4.9
|
75.5
|
1.0
|
O
|
B:ILE676
|
4.9
|
77.7
|
1.0
|
C12
|
B:NFL2204
|
4.9
|
145.5
|
1.0
|
CD2
|
B:LEU677
|
5.0
|
87.0
|
1.0
|
CG
|
B:PRO467
|
5.0
|
76.1
|
1.0
|
CD1
|
B:LEU677
|
5.0
|
85.2
|
1.0
|
|
Fluorine binding site 6 out
of 6 in 7ty8
Go back to
Fluorine Binding Sites List in 7ty8
Fluorine binding site 6 out
of 6 in the Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 6 of Cryo-Em Structure of Human Anion Exchanger 1 Bound to Niflumic Acid within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:F2204
b:142.1
occ:1.00
|
F2
|
B:NFL2204
|
0.0
|
142.1
|
1.0
|
C15
|
B:NFL2204
|
1.3
|
145.3
|
1.0
|
F1
|
B:NFL2204
|
2.1
|
145.9
|
1.0
|
F3
|
B:NFL2204
|
2.1
|
145.8
|
1.0
|
C9
|
B:NFL2204
|
2.4
|
146.3
|
1.0
|
C14
|
B:NFL2204
|
2.8
|
147.3
|
1.0
|
N
|
B:GLU681
|
2.9
|
70.8
|
1.0
|
O
|
B:LEU677
|
3.2
|
76.2
|
1.0
|
CA
|
B:GLU681
|
3.2
|
70.7
|
1.0
|
C
|
B:LEU680
|
3.4
|
70.0
|
1.0
|
CB
|
B:GLU681
|
3.4
|
75.6
|
1.0
|
C10
|
B:NFL2204
|
3.6
|
146.9
|
1.0
|
O
|
B:LEU680
|
3.8
|
72.1
|
1.0
|
CB
|
B:LEU680
|
3.8
|
72.3
|
1.0
|
CE2
|
B:PHE524
|
4.0
|
59.3
|
1.0
|
CA
|
B:LEU680
|
4.1
|
70.8
|
1.0
|
C13
|
B:NFL2204
|
4.1
|
146.7
|
1.0
|
OE1
|
B:GLU681
|
4.1
|
87.4
|
1.0
|
C
|
B:LEU677
|
4.3
|
74.2
|
1.0
|
CD
|
B:GLU681
|
4.5
|
86.0
|
1.0
|
CG
|
B:GLU681
|
4.5
|
80.3
|
1.0
|
CA
|
B:LEU677
|
4.6
|
77.7
|
1.0
|
CD2
|
B:LEU863
|
4.7
|
90.0
|
1.0
|
N
|
B:LEU680
|
4.7
|
71.2
|
1.0
|
C11
|
B:NFL2204
|
4.7
|
145.6
|
1.0
|
C
|
B:GLU681
|
4.7
|
64.7
|
1.0
|
CZ
|
B:PHE524
|
4.8
|
58.8
|
1.0
|
CD2
|
B:PHE524
|
4.9
|
61.2
|
1.0
|
C12
|
B:NFL2204
|
4.9
|
145.5
|
1.0
|
O
|
B:ILE676
|
4.9
|
77.7
|
1.0
|
|
Reference:
M.J.Capper,
S.Yang,
A.C.Stone,
S.Vatansever,
G.Zilberg,
Y.K.Mathiharan,
R.Habib,
K.Hutchinson,
A.Schlessinger,
M.Mezei,
R.Osman,
B.Zhang,
D.Wacker.
Substrate Binding and Inhibition of the Anion Exchanger 1 Bicarbonate Transporter To Be Published.
Page generated: Fri Aug 2 13:45:34 2024
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