Chlorine in PDB 6b5v: Structure of TRPV5 in Complex with Econazole
Other elements in 6b5v:
The structure of Structure of TRPV5 in Complex with Econazole also contains other interesting chemical elements:
Chlorine Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
12;
Binding sites:
The binding sites of Chlorine atom in the Structure of TRPV5 in Complex with Econazole
(pdb code 6b5v). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 12 binding sites of Chlorine where determined in the
Structure of TRPV5 in Complex with Econazole, PDB code: 6b5v:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Chlorine binding site 1 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 1 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl1001
b:30.0
occ:1.00
|
CL2
|
A:ECL1001
|
0.0
|
30.0
|
1.0
|
C11
|
A:ECL1001
|
1.8
|
30.0
|
1.0
|
C13
|
A:ECL1001
|
2.7
|
30.0
|
1.0
|
H13
|
A:ECL1001
|
2.8
|
30.0
|
1.0
|
C9
|
A:ECL1001
|
2.9
|
30.0
|
1.0
|
H9
|
A:ECL1001
|
3.0
|
30.0
|
1.0
|
CE1
|
A:PHE456
|
3.4
|
0.7
|
1.0
|
CZ
|
A:PHE456
|
3.9
|
0.7
|
1.0
|
C10
|
A:ECL1001
|
4.1
|
30.0
|
1.0
|
C2
|
A:ECL1001
|
4.1
|
30.0
|
1.0
|
CD1
|
A:PHE456
|
4.6
|
0.7
|
1.0
|
C1
|
A:ECL1001
|
4.6
|
30.0
|
1.0
|
H10
|
A:ECL1001
|
4.8
|
30.0
|
1.0
|
H2
|
A:ECL1001
|
4.8
|
30.0
|
1.0
|
|
Chlorine binding site 2 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 2 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl1001
b:30.0
occ:1.00
|
CL4
|
A:ECL1001
|
0.0
|
30.0
|
1.0
|
C14
|
A:ECL1001
|
1.8
|
30.0
|
1.0
|
C5
|
A:ECL1001
|
2.7
|
30.0
|
1.0
|
H5
|
A:ECL1001
|
2.8
|
30.0
|
1.0
|
C15
|
A:ECL1001
|
2.9
|
30.0
|
1.0
|
H15
|
A:ECL1001
|
3.0
|
30.0
|
1.0
|
CE1
|
A:PHE425
|
3.4
|
0.8
|
1.0
|
CZ
|
A:PHE425
|
3.4
|
0.8
|
1.0
|
CD1
|
A:ILE482
|
3.6
|
0.3
|
1.0
|
C16
|
A:ECL1001
|
4.1
|
30.0
|
1.0
|
C21
|
A:ECL1001
|
4.1
|
30.0
|
1.0
|
CB
|
A:GLN483
|
4.4
|
0.1
|
1.0
|
CG
|
A:GLN483
|
4.5
|
0.1
|
1.0
|
CD1
|
A:PHE425
|
4.6
|
0.8
|
1.0
|
CE2
|
A:PHE425
|
4.6
|
0.8
|
1.0
|
C17
|
A:ECL1001
|
4.6
|
30.0
|
1.0
|
CA
|
A:GLN483
|
4.7
|
0.1
|
1.0
|
H21
|
A:ECL1001
|
4.8
|
30.0
|
1.0
|
N
|
A:GLN483
|
5.0
|
0.1
|
1.0
|
|
Chlorine binding site 3 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 3 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl1001
b:30.0
occ:1.00
|
CL8
|
A:ECL1001
|
0.0
|
30.0
|
1.0
|
C16
|
A:ECL1001
|
1.8
|
30.0
|
1.0
|
H8A
|
A:ECL1001
|
2.6
|
30.0
|
1.0
|
C15
|
A:ECL1001
|
2.7
|
30.0
|
1.0
|
H15
|
A:ECL1001
|
2.7
|
30.0
|
1.0
|
O20
|
A:ECL1001
|
2.7
|
30.0
|
1.0
|
C8
|
A:ECL1001
|
2.9
|
30.0
|
1.0
|
C17
|
A:ECL1001
|
2.9
|
30.0
|
1.0
|
H8
|
A:ECL1001
|
2.9
|
30.0
|
1.0
|
C20
|
A:ECL1001
|
3.3
|
30.0
|
1.0
|
H20
|
A:ECL1001
|
3.7
|
30.0
|
1.0
|
SG
|
A:CYS463
|
3.9
|
0.8
|
1.0
|
C14
|
A:ECL1001
|
4.1
|
30.0
|
1.0
|
C21
|
A:ECL1001
|
4.1
|
30.0
|
1.0
|
CD1
|
C:ILE565
|
4.4
|
0.7
|
1.0
|
C1
|
A:ECL1001
|
4.4
|
30.0
|
1.0
|
C19
|
A:ECL1001
|
4.6
|
30.0
|
1.0
|
C5
|
A:ECL1001
|
4.6
|
30.0
|
1.0
|
H19A
|
A:ECL1001
|
4.8
|
30.0
|
1.0
|
H19
|
A:ECL1001
|
4.8
|
30.0
|
1.0
|
H21
|
A:ECL1001
|
4.9
|
30.0
|
1.0
|
H2
|
A:ECL1001
|
4.9
|
30.0
|
1.0
|
|
Chlorine binding site 4 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 4 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl1001
b:30.0
occ:1.00
|
CL2
|
B:ECL1001
|
0.0
|
30.0
|
1.0
|
C11
|
B:ECL1001
|
1.8
|
30.0
|
1.0
|
C13
|
B:ECL1001
|
2.7
|
30.0
|
1.0
|
H13
|
B:ECL1001
|
2.8
|
30.0
|
1.0
|
C9
|
B:ECL1001
|
2.9
|
30.0
|
1.0
|
H9
|
B:ECL1001
|
3.0
|
30.0
|
1.0
|
CE1
|
B:PHE456
|
3.4
|
0.7
|
1.0
|
CZ
|
B:PHE456
|
3.9
|
0.7
|
1.0
|
C10
|
B:ECL1001
|
4.1
|
30.0
|
1.0
|
C2
|
B:ECL1001
|
4.1
|
30.0
|
1.0
|
CD1
|
B:PHE456
|
4.6
|
0.7
|
1.0
|
C1
|
B:ECL1001
|
4.6
|
30.0
|
1.0
|
H10
|
B:ECL1001
|
4.8
|
30.0
|
1.0
|
H2
|
B:ECL1001
|
4.8
|
30.0
|
1.0
|
|
Chlorine binding site 5 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 5 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl1001
b:30.0
occ:1.00
|
CL4
|
B:ECL1001
|
0.0
|
30.0
|
1.0
|
C14
|
B:ECL1001
|
1.8
|
30.0
|
1.0
|
C5
|
B:ECL1001
|
2.7
|
30.0
|
1.0
|
H5
|
B:ECL1001
|
2.8
|
30.0
|
1.0
|
C15
|
B:ECL1001
|
2.9
|
30.0
|
1.0
|
H15
|
B:ECL1001
|
3.0
|
30.0
|
1.0
|
CE1
|
B:PHE425
|
3.4
|
0.8
|
1.0
|
CZ
|
B:PHE425
|
3.5
|
0.8
|
1.0
|
CD1
|
B:ILE482
|
3.6
|
0.3
|
1.0
|
C16
|
B:ECL1001
|
4.1
|
30.0
|
1.0
|
C21
|
B:ECL1001
|
4.1
|
30.0
|
1.0
|
CB
|
B:GLN483
|
4.4
|
0.1
|
1.0
|
CG
|
B:GLN483
|
4.5
|
0.1
|
1.0
|
CD1
|
B:PHE425
|
4.6
|
0.8
|
1.0
|
CE2
|
B:PHE425
|
4.6
|
0.8
|
1.0
|
C17
|
B:ECL1001
|
4.6
|
30.0
|
1.0
|
CA
|
B:GLN483
|
4.7
|
0.1
|
1.0
|
H21
|
B:ECL1001
|
4.8
|
30.0
|
1.0
|
N
|
B:GLN483
|
5.0
|
0.1
|
1.0
|
|
Chlorine binding site 6 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 6 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl1001
b:30.0
occ:1.00
|
CL8
|
B:ECL1001
|
0.0
|
30.0
|
1.0
|
C16
|
B:ECL1001
|
1.8
|
30.0
|
1.0
|
H8A
|
B:ECL1001
|
2.6
|
30.0
|
1.0
|
C15
|
B:ECL1001
|
2.7
|
30.0
|
1.0
|
H15
|
B:ECL1001
|
2.7
|
30.0
|
1.0
|
O20
|
B:ECL1001
|
2.7
|
30.0
|
1.0
|
C8
|
B:ECL1001
|
2.9
|
30.0
|
1.0
|
C17
|
B:ECL1001
|
2.9
|
30.0
|
1.0
|
H8
|
B:ECL1001
|
2.9
|
30.0
|
1.0
|
C20
|
B:ECL1001
|
3.3
|
30.0
|
1.0
|
H20
|
B:ECL1001
|
3.7
|
30.0
|
1.0
|
SG
|
B:CYS463
|
3.9
|
0.8
|
1.0
|
C14
|
B:ECL1001
|
4.1
|
30.0
|
1.0
|
C21
|
B:ECL1001
|
4.1
|
30.0
|
1.0
|
C1
|
B:ECL1001
|
4.4
|
30.0
|
1.0
|
CD1
|
A:ILE565
|
4.5
|
0.7
|
1.0
|
C19
|
B:ECL1001
|
4.6
|
30.0
|
1.0
|
C5
|
B:ECL1001
|
4.6
|
30.0
|
1.0
|
H19A
|
B:ECL1001
|
4.8
|
30.0
|
1.0
|
H19
|
B:ECL1001
|
4.8
|
30.0
|
1.0
|
H21
|
B:ECL1001
|
4.9
|
30.0
|
1.0
|
H2
|
B:ECL1001
|
4.9
|
30.0
|
1.0
|
|
Chlorine binding site 7 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 7 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl1001
b:30.0
occ:1.00
|
CL2
|
D:ECL1001
|
0.0
|
30.0
|
1.0
|
C11
|
D:ECL1001
|
1.8
|
30.0
|
1.0
|
C13
|
D:ECL1001
|
2.7
|
30.0
|
1.0
|
H13
|
D:ECL1001
|
2.8
|
30.0
|
1.0
|
C9
|
D:ECL1001
|
2.9
|
30.0
|
1.0
|
H9
|
D:ECL1001
|
3.0
|
30.0
|
1.0
|
CE1
|
D:PHE456
|
3.4
|
0.7
|
1.0
|
CZ
|
D:PHE456
|
3.9
|
0.7
|
1.0
|
C10
|
D:ECL1001
|
4.1
|
30.0
|
1.0
|
C2
|
D:ECL1001
|
4.1
|
30.0
|
1.0
|
CD1
|
D:PHE456
|
4.6
|
0.7
|
1.0
|
C1
|
D:ECL1001
|
4.6
|
30.0
|
1.0
|
H10
|
D:ECL1001
|
4.8
|
30.0
|
1.0
|
H2
|
D:ECL1001
|
4.8
|
30.0
|
1.0
|
|
Chlorine binding site 8 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 8 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 8 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl1001
b:30.0
occ:1.00
|
CL4
|
D:ECL1001
|
0.0
|
30.0
|
1.0
|
C14
|
D:ECL1001
|
1.8
|
30.0
|
1.0
|
C5
|
D:ECL1001
|
2.7
|
30.0
|
1.0
|
H5
|
D:ECL1001
|
2.8
|
30.0
|
1.0
|
C15
|
D:ECL1001
|
2.9
|
30.0
|
1.0
|
H15
|
D:ECL1001
|
3.0
|
30.0
|
1.0
|
CE1
|
D:PHE425
|
3.4
|
0.8
|
1.0
|
CZ
|
D:PHE425
|
3.4
|
0.8
|
1.0
|
CD1
|
D:ILE482
|
3.6
|
0.3
|
1.0
|
C16
|
D:ECL1001
|
4.1
|
30.0
|
1.0
|
C21
|
D:ECL1001
|
4.1
|
30.0
|
1.0
|
CB
|
D:GLN483
|
4.4
|
0.1
|
1.0
|
CG
|
D:GLN483
|
4.5
|
0.1
|
1.0
|
CD1
|
D:PHE425
|
4.6
|
0.8
|
1.0
|
CE2
|
D:PHE425
|
4.6
|
0.8
|
1.0
|
C17
|
D:ECL1001
|
4.6
|
30.0
|
1.0
|
CA
|
D:GLN483
|
4.7
|
0.1
|
1.0
|
H21
|
D:ECL1001
|
4.8
|
30.0
|
1.0
|
N
|
D:GLN483
|
5.0
|
0.1
|
1.0
|
|
Chlorine binding site 9 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 9 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 9 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl1001
b:30.0
occ:1.00
|
CL8
|
D:ECL1001
|
0.0
|
30.0
|
1.0
|
C16
|
D:ECL1001
|
1.8
|
30.0
|
1.0
|
H8A
|
D:ECL1001
|
2.6
|
30.0
|
1.0
|
C15
|
D:ECL1001
|
2.7
|
30.0
|
1.0
|
H15
|
D:ECL1001
|
2.7
|
30.0
|
1.0
|
O20
|
D:ECL1001
|
2.7
|
30.0
|
1.0
|
C8
|
D:ECL1001
|
2.9
|
30.0
|
1.0
|
C17
|
D:ECL1001
|
2.9
|
30.0
|
1.0
|
H8
|
D:ECL1001
|
2.9
|
30.0
|
1.0
|
C20
|
D:ECL1001
|
3.3
|
30.0
|
1.0
|
H20
|
D:ECL1001
|
3.7
|
30.0
|
1.0
|
SG
|
D:CYS463
|
3.9
|
0.8
|
1.0
|
C14
|
D:ECL1001
|
4.1
|
30.0
|
1.0
|
C21
|
D:ECL1001
|
4.1
|
30.0
|
1.0
|
CD1
|
B:ILE565
|
4.4
|
0.7
|
1.0
|
C1
|
D:ECL1001
|
4.4
|
30.0
|
1.0
|
C19
|
D:ECL1001
|
4.6
|
30.0
|
1.0
|
C5
|
D:ECL1001
|
4.6
|
30.0
|
1.0
|
H19A
|
D:ECL1001
|
4.8
|
30.0
|
1.0
|
H19
|
D:ECL1001
|
4.8
|
30.0
|
1.0
|
H21
|
D:ECL1001
|
4.9
|
30.0
|
1.0
|
H2
|
D:ECL1001
|
4.9
|
30.0
|
1.0
|
|
Chlorine binding site 10 out
of 12 in 6b5v
Go back to
Chlorine Binding Sites List in 6b5v
Chlorine binding site 10 out
of 12 in the Structure of TRPV5 in Complex with Econazole
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 10 of Structure of TRPV5 in Complex with Econazole within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl1001
b:30.0
occ:1.00
|
CL2
|
C:ECL1001
|
0.0
|
30.0
|
1.0
|
C11
|
C:ECL1001
|
1.8
|
30.0
|
1.0
|
C13
|
C:ECL1001
|
2.7
|
30.0
|
1.0
|
H13
|
C:ECL1001
|
2.8
|
30.0
|
1.0
|
C9
|
C:ECL1001
|
2.9
|
30.0
|
1.0
|
H9
|
C:ECL1001
|
3.0
|
30.0
|
1.0
|
CE1
|
C:PHE456
|
3.4
|
0.7
|
1.0
|
CZ
|
C:PHE456
|
3.9
|
0.7
|
1.0
|
C10
|
C:ECL1001
|
4.1
|
30.0
|
1.0
|
C2
|
C:ECL1001
|
4.1
|
30.0
|
1.0
|
CD1
|
C:PHE456
|
4.6
|
0.7
|
1.0
|
C1
|
C:ECL1001
|
4.6
|
30.0
|
1.0
|
H10
|
C:ECL1001
|
4.8
|
30.0
|
1.0
|
H2
|
C:ECL1001
|
4.8
|
30.0
|
1.0
|
|
Reference:
T.E.T.Hughes,
D.T.Lodowski,
K.W.Huynh,
A.Yazici,
J.Del Rosario,
A.Kapoor,
S.Basak,
A.Samanta,
X.Han,
S.Chakrapani,
Z.H.Zhou,
M.Filizola,
T.Rohacs,
S.Han,
V.Y.Moiseenkova-Bell.
Structural Basis of TRPV5 Channel Inhibition By Econazole Revealed By Cryo-Em. Nat. Struct. Mol. Biol. V. 25 53 2018.
ISSN: ESSN 1545-9985
PubMed: 29323279
DOI: 10.1038/S41594-017-0009-1
Page generated: Fri Jul 26 22:33:32 2024
|