Calcium in PDB 7zk3: Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution
Other elements in 7zk3:
The structure of Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution also contains other interesting chemical elements:
Calcium Binding Sites:
The binding sites of Calcium atom in the Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution
(pdb code 7zk3). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 6 binding sites of Calcium where determined in the
Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution, PDB code: 7zk3:
Jump to Calcium binding site number:
1;
2;
3;
4;
5;
6;
Calcium binding site 1 out
of 6 in 7zk3
Go back to
Calcium Binding Sites List in 7zk3
Calcium binding site 1 out
of 6 in the Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1001
b:23.7
occ:1.00
|
OE1
|
A:GLU702
|
2.4
|
25.3
|
1.0
|
OE1
|
A:GLU705
|
2.4
|
20.7
|
1.0
|
OE2
|
A:GLU734
|
2.5
|
13.5
|
1.0
|
OD1
|
A:ASP738
|
3.1
|
14.4
|
1.0
|
OE2
|
A:GLU654
|
3.1
|
25.1
|
1.0
|
OE1
|
A:GLU654
|
3.2
|
25.1
|
1.0
|
CD
|
A:GLU702
|
3.3
|
25.3
|
1.0
|
OD2
|
A:ASP738
|
3.4
|
14.4
|
1.0
|
CD
|
A:GLU654
|
3.5
|
25.1
|
1.0
|
CD
|
A:GLU734
|
3.5
|
13.5
|
1.0
|
CD
|
A:GLU705
|
3.6
|
20.7
|
1.0
|
CG
|
A:ASP738
|
3.7
|
14.4
|
1.0
|
OE2
|
A:GLU702
|
3.9
|
25.3
|
1.0
|
CA
|
A:GLU702
|
4.0
|
25.3
|
1.0
|
CG
|
A:GLU734
|
4.1
|
13.5
|
1.0
|
CB
|
A:GLU702
|
4.1
|
25.3
|
1.0
|
CA
|
A:CA1002
|
4.1
|
24.8
|
1.0
|
OE2
|
A:GLU705
|
4.1
|
20.7
|
1.0
|
OH
|
A:TYR331
|
4.2
|
28.5
|
1.0
|
CG
|
A:GLU702
|
4.3
|
25.3
|
1.0
|
OE1
|
A:GLU734
|
4.6
|
13.5
|
1.0
|
NZ
|
A:LYS741
|
4.6
|
16.7
|
1.0
|
CE
|
A:MET706
|
4.6
|
18.8
|
1.0
|
CG
|
A:GLU705
|
4.8
|
20.7
|
1.0
|
CB
|
A:GLU705
|
4.8
|
20.7
|
1.0
|
O
|
A:GLU702
|
4.9
|
25.3
|
1.0
|
N
|
A:GLU702
|
4.9
|
25.3
|
1.0
|
C
|
A:GLU702
|
5.0
|
25.3
|
1.0
|
CG
|
A:GLU654
|
5.0
|
25.1
|
1.0
|
|
Calcium binding site 2 out
of 6 in 7zk3
Go back to
Calcium Binding Sites List in 7zk3
Calcium binding site 2 out
of 6 in the Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1002
b:24.8
occ:1.00
|
OD1
|
A:ASN650
|
2.4
|
21.4
|
1.0
|
OE1
|
A:GLU734
|
2.4
|
13.5
|
1.0
|
OE2
|
A:GLU654
|
2.5
|
25.1
|
1.0
|
OE2
|
A:GLU734
|
2.5
|
13.5
|
1.0
|
OD1
|
A:ASN651
|
2.6
|
19.9
|
1.0
|
CD
|
A:GLU734
|
2.8
|
13.5
|
1.0
|
CG
|
A:ASN650
|
3.4
|
21.4
|
1.0
|
CG
|
A:ASN651
|
3.6
|
19.9
|
1.0
|
CD
|
A:GLU654
|
3.6
|
25.1
|
1.0
|
OE1
|
A:GLU705
|
3.7
|
20.7
|
1.0
|
ND2
|
A:ASN650
|
4.1
|
21.4
|
1.0
|
CA
|
A:CA1001
|
4.1
|
23.7
|
1.0
|
CD
|
A:GLU705
|
4.2
|
20.7
|
1.0
|
N
|
A:ASN651
|
4.2
|
19.9
|
1.0
|
CG
|
A:GLU734
|
4.3
|
13.5
|
1.0
|
CA
|
A:ASN651
|
4.3
|
19.9
|
1.0
|
ND2
|
A:ASN651
|
4.3
|
19.9
|
1.0
|
CB
|
A:ASN650
|
4.4
|
21.4
|
1.0
|
OE1
|
A:GLU654
|
4.4
|
25.1
|
1.0
|
O
|
A:GLN646
|
4.4
|
16.3
|
1.0
|
C
|
A:ASN650
|
4.4
|
21.4
|
1.0
|
OE2
|
A:GLU705
|
4.4
|
20.7
|
1.0
|
CG
|
A:GLU654
|
4.5
|
25.1
|
1.0
|
OD1
|
A:ASN730
|
4.5
|
12.3
|
1.0
|
CB
|
A:ASN651
|
4.6
|
19.9
|
1.0
|
O
|
A:ASN650
|
4.6
|
21.4
|
1.0
|
|
Calcium binding site 3 out
of 6 in 7zk3
Go back to
Calcium Binding Sites List in 7zk3
Calcium binding site 3 out
of 6 in the Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1004
b:31.2
occ:1.00
|
O
|
A:ASP883
|
2.5
|
21.3
|
1.0
|
OD1
|
A:ASP888
|
2.5
|
33.6
|
1.0
|
O
|
A:ILE886
|
2.5
|
20.2
|
1.0
|
OD2
|
A:ASP883
|
3.0
|
21.3
|
1.0
|
OE1
|
A:GLU425
|
3.3
|
17.6
|
1.0
|
CG
|
A:ASP888
|
3.6
|
33.6
|
1.0
|
C
|
A:ASP883
|
3.6
|
21.3
|
1.0
|
C
|
A:ILE886
|
3.7
|
20.2
|
1.0
|
N
|
A:ASP888
|
3.9
|
33.6
|
1.0
|
C
|
A:PRO887
|
4.1
|
25.9
|
1.0
|
CA
|
A:PRO887
|
4.2
|
25.9
|
1.0
|
CG
|
A:ASP883
|
4.3
|
21.3
|
1.0
|
OD2
|
A:ASP888
|
4.3
|
33.6
|
1.0
|
CD
|
A:GLU425
|
4.4
|
17.6
|
1.0
|
CA
|
A:ASP888
|
4.4
|
33.6
|
1.0
|
CA
|
A:ASP883
|
4.5
|
21.3
|
1.0
|
N
|
A:PRO887
|
4.5
|
25.9
|
1.0
|
N
|
A:TRP884
|
4.6
|
24.5
|
1.0
|
CB
|
A:ASP888
|
4.6
|
33.6
|
1.0
|
CA
|
A:TRP884
|
4.6
|
24.5
|
1.0
|
NZ
|
A:LYS428
|
4.6
|
19.0
|
1.0
|
O
|
A:TRP884
|
4.7
|
24.5
|
1.0
|
C
|
A:TRP884
|
4.8
|
24.5
|
1.0
|
CA
|
A:ILE886
|
4.8
|
20.2
|
1.0
|
O
|
A:PRO887
|
4.8
|
25.9
|
1.0
|
N
|
A:ILE886
|
4.8
|
20.2
|
1.0
|
CB
|
A:ASP883
|
5.0
|
21.3
|
1.0
|
|
Calcium binding site 4 out
of 6 in 7zk3
Go back to
Calcium Binding Sites List in 7zk3
Calcium binding site 4 out
of 6 in the Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1001
b:22.6
occ:1.00
|
OE1
|
B:GLU702
|
2.4
|
21.6
|
1.0
|
OE1
|
B:GLU705
|
2.4
|
19.1
|
1.0
|
OE2
|
B:GLU734
|
2.5
|
13.9
|
1.0
|
OD1
|
B:ASP738
|
3.1
|
14.7
|
1.0
|
OE2
|
B:GLU654
|
3.1
|
24.9
|
1.0
|
OE1
|
B:GLU654
|
3.2
|
24.9
|
1.0
|
CD
|
B:GLU702
|
3.3
|
21.6
|
1.0
|
OD2
|
B:ASP738
|
3.4
|
14.7
|
1.0
|
CD
|
B:GLU654
|
3.5
|
24.9
|
1.0
|
CD
|
B:GLU734
|
3.5
|
13.9
|
1.0
|
CD
|
B:GLU705
|
3.6
|
19.1
|
1.0
|
CG
|
B:ASP738
|
3.7
|
14.7
|
1.0
|
OE2
|
B:GLU702
|
3.9
|
21.6
|
1.0
|
CA
|
B:GLU702
|
4.0
|
21.6
|
1.0
|
CG
|
B:GLU734
|
4.1
|
13.9
|
1.0
|
CB
|
B:GLU702
|
4.1
|
21.6
|
1.0
|
CA
|
B:CA1002
|
4.1
|
25.7
|
1.0
|
OE2
|
B:GLU705
|
4.1
|
19.1
|
1.0
|
OH
|
B:TYR331
|
4.2
|
28.5
|
1.0
|
CG
|
B:GLU702
|
4.3
|
21.6
|
1.0
|
OE1
|
B:GLU734
|
4.6
|
13.9
|
1.0
|
NZ
|
B:LYS741
|
4.6
|
16.9
|
1.0
|
CE
|
B:MET706
|
4.6
|
17.4
|
1.0
|
CG
|
B:GLU705
|
4.8
|
19.1
|
1.0
|
CB
|
B:GLU705
|
4.8
|
19.1
|
1.0
|
O
|
B:GLU702
|
4.9
|
21.6
|
1.0
|
N
|
B:GLU702
|
4.9
|
21.6
|
1.0
|
C
|
B:GLU702
|
5.0
|
21.6
|
1.0
|
CG
|
B:GLU654
|
5.0
|
24.9
|
1.0
|
|
Calcium binding site 5 out
of 6 in 7zk3
Go back to
Calcium Binding Sites List in 7zk3
Calcium binding site 5 out
of 6 in the Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 5 of Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1002
b:25.7
occ:1.00
|
OD1
|
B:ASN650
|
2.4
|
21.9
|
1.0
|
OE1
|
B:GLU734
|
2.4
|
13.9
|
1.0
|
OE2
|
B:GLU654
|
2.5
|
24.9
|
1.0
|
OE2
|
B:GLU734
|
2.5
|
13.9
|
1.0
|
OD1
|
B:ASN651
|
2.6
|
20.2
|
1.0
|
CD
|
B:GLU734
|
2.8
|
13.9
|
1.0
|
CG
|
B:ASN650
|
3.4
|
21.9
|
1.0
|
CG
|
B:ASN651
|
3.6
|
20.2
|
1.0
|
CD
|
B:GLU654
|
3.6
|
24.9
|
1.0
|
OE1
|
B:GLU705
|
3.7
|
19.1
|
1.0
|
CA
|
B:CA1001
|
4.1
|
22.6
|
1.0
|
ND2
|
B:ASN650
|
4.1
|
21.9
|
1.0
|
CD
|
B:GLU705
|
4.2
|
19.1
|
1.0
|
N
|
B:ASN651
|
4.3
|
20.2
|
1.0
|
CG
|
B:GLU734
|
4.3
|
13.9
|
1.0
|
CA
|
B:ASN651
|
4.3
|
20.2
|
1.0
|
ND2
|
B:ASN651
|
4.3
|
20.2
|
1.0
|
CB
|
B:ASN650
|
4.4
|
21.9
|
1.0
|
OE1
|
B:GLU654
|
4.4
|
24.9
|
1.0
|
O
|
B:GLN646
|
4.4
|
16.5
|
1.0
|
C
|
B:ASN650
|
4.4
|
21.9
|
1.0
|
OE2
|
B:GLU705
|
4.5
|
19.1
|
1.0
|
CG
|
B:GLU654
|
4.5
|
24.9
|
1.0
|
OD1
|
B:ASN730
|
4.5
|
12.2
|
1.0
|
CB
|
B:ASN651
|
4.6
|
20.2
|
1.0
|
O
|
B:ASN650
|
4.6
|
21.9
|
1.0
|
|
Calcium binding site 6 out
of 6 in 7zk3
Go back to
Calcium Binding Sites List in 7zk3
Calcium binding site 6 out
of 6 in the Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 6 of Structure of 1PBC- and Calcium-Bound MTMEM16A(Ac) Chloride Channel at 2.85 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1004
b:31.5
occ:1.00
|
O
|
B:ASP883
|
2.5
|
20.5
|
1.0
|
OD1
|
B:ASP888
|
2.5
|
35.0
|
1.0
|
O
|
B:ILE886
|
2.5
|
20.5
|
1.0
|
OD2
|
B:ASP883
|
3.0
|
20.5
|
1.0
|
OE1
|
B:GLU425
|
3.3
|
15.5
|
1.0
|
CG
|
B:ASP888
|
3.6
|
35.0
|
1.0
|
C
|
B:ASP883
|
3.6
|
20.5
|
1.0
|
C
|
B:ILE886
|
3.7
|
20.5
|
1.0
|
N
|
B:ASP888
|
3.9
|
35.0
|
1.0
|
C
|
B:PRO887
|
4.1
|
26.5
|
1.0
|
CA
|
B:PRO887
|
4.2
|
26.5
|
1.0
|
CG
|
B:ASP883
|
4.3
|
20.5
|
1.0
|
OD2
|
B:ASP888
|
4.3
|
35.0
|
1.0
|
CD
|
B:GLU425
|
4.4
|
15.5
|
1.0
|
CA
|
B:ASP888
|
4.4
|
35.0
|
1.0
|
CA
|
B:ASP883
|
4.5
|
20.5
|
1.0
|
N
|
B:PRO887
|
4.5
|
26.5
|
1.0
|
N
|
B:TRP884
|
4.6
|
24.1
|
1.0
|
CB
|
B:ASP888
|
4.6
|
35.0
|
1.0
|
CA
|
B:TRP884
|
4.6
|
24.1
|
1.0
|
NZ
|
B:LYS428
|
4.6
|
18.7
|
1.0
|
O
|
B:TRP884
|
4.7
|
24.1
|
1.0
|
C
|
B:TRP884
|
4.8
|
24.1
|
1.0
|
CA
|
B:ILE886
|
4.8
|
20.5
|
1.0
|
O
|
B:PRO887
|
4.8
|
26.5
|
1.0
|
N
|
B:ILE886
|
4.8
|
20.5
|
1.0
|
CB
|
B:ASP883
|
5.0
|
20.5
|
1.0
|
|
Reference:
A.K.M.Lam,
S.Rutz,
R.Dutzler.
Inhibition Mechanism of the Chloride Channel TMEM16A By the Pore Blocker 1PBC. Nat Commun V. 13 2798 2022.
ISSN: ESSN 2041-1723
PubMed: 35589730
DOI: 10.1038/S41467-022-30479-1
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