Chlorine in PDB 6hzw: The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
Protein crystallography data
The structure of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution, PDB code: 6hzw
was solved by
H.D.Hu,
M.Delarue,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
20.00 /
2.22
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
182.416,
133.401,
160.474,
90.00,
102.48,
90.00
|
R / Rfree (%)
|
19.5 /
22
|
Other elements in 6hzw:
The structure of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
(pdb code 6hzw). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 7 binding sites of Chlorine where determined in the
The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution, PDB code: 6hzw:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
Chlorine binding site 1 out
of 7 in 6hzw
Go back to
Chlorine Binding Sites List in 6hzw
Chlorine binding site 1 out
of 7 in the The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl404
b:35.2
occ:1.00
|
O
|
A:HOH570
|
2.7
|
40.2
|
1.0
|
O
|
A:HOH594
|
3.0
|
47.1
|
1.0
|
N
|
A:PHE78
|
3.4
|
26.9
|
1.0
|
NH1
|
A:ARG85
|
3.5
|
29.7
|
1.0
|
N
|
A:ARG85
|
3.5
|
31.4
|
1.0
|
CD2
|
A:PHE78
|
3.7
|
42.6
|
1.0
|
CA
|
A:ALA84
|
3.9
|
33.0
|
1.0
|
CB
|
A:PHE78
|
4.0
|
30.3
|
1.0
|
CA
|
A:ARG77
|
4.0
|
26.6
|
1.0
|
CG
|
A:ARG85
|
4.0
|
31.8
|
1.0
|
CB
|
A:ARG85
|
4.1
|
33.9
|
1.0
|
CD
|
A:ARG85
|
4.1
|
32.4
|
1.0
|
C
|
A:ARG77
|
4.2
|
26.4
|
1.0
|
CA
|
A:PHE78
|
4.2
|
26.4
|
1.0
|
C
|
A:ALA84
|
4.2
|
33.1
|
1.0
|
CB
|
A:ARG77
|
4.3
|
29.1
|
1.0
|
CG2
|
A:VAL81
|
4.3
|
35.3
|
1.0
|
CG
|
A:PHE78
|
4.3
|
37.0
|
1.0
|
CB
|
A:ALA84
|
4.4
|
31.4
|
1.0
|
CA
|
A:ARG85
|
4.4
|
31.3
|
1.0
|
O
|
A:PHE78
|
4.5
|
25.4
|
1.0
|
CZ
|
A:ARG85
|
4.6
|
29.5
|
1.0
|
O
|
A:HOH562
|
4.6
|
41.2
|
1.0
|
CG
|
A:ARG77
|
4.7
|
31.6
|
1.0
|
CE2
|
A:PHE78
|
4.7
|
49.4
|
1.0
|
NE
|
A:ARG85
|
4.8
|
34.1
|
1.0
|
C
|
A:PHE78
|
4.8
|
23.9
|
1.0
|
O
|
A:ILE76
|
5.0
|
26.7
|
1.0
|
|
Chlorine binding site 2 out
of 7 in 6hzw
Go back to
Chlorine Binding Sites List in 6hzw
Chlorine binding site 2 out
of 7 in the The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl405
b:49.2
occ:1.00
|
N
|
A:LEU180
|
3.2
|
25.2
|
1.0
|
OD1
|
A:ASN139
|
3.3
|
36.3
|
1.0
|
CB
|
A:LEU180
|
3.8
|
31.6
|
1.0
|
CA
|
A:ARG179
|
3.8
|
29.2
|
1.0
|
C
|
A:ARG179
|
3.9
|
27.4
|
1.0
|
CA
|
A:LEU180
|
4.0
|
28.3
|
1.0
|
CG
|
A:ASN139
|
4.0
|
43.1
|
1.0
|
ND2
|
A:ASN139
|
4.3
|
56.8
|
1.0
|
CB
|
A:SER134
|
4.4
|
28.2
|
1.0
|
CD
|
A:ARG179
|
4.4
|
44.3
|
1.0
|
O
|
A:ASP178
|
4.4
|
33.4
|
1.0
|
CB
|
A:ARG179
|
4.4
|
32.0
|
1.0
|
OG
|
A:SER134
|
4.8
|
26.4
|
1.0
|
N
|
A:ARG179
|
4.9
|
29.9
|
1.0
|
CG
|
A:ARG179
|
4.9
|
37.4
|
1.0
|
|
Chlorine binding site 3 out
of 7 in 6hzw
Go back to
Chlorine Binding Sites List in 6hzw
Chlorine binding site 3 out
of 7 in the The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl406
b:61.2
occ:1.00
|
N
|
A:ALA175
|
3.4
|
24.9
|
1.0
|
CB
|
A:ALA175
|
3.8
|
33.4
|
1.0
|
CA
|
A:PHE174
|
4.2
|
24.3
|
1.0
|
CA
|
A:ALA175
|
4.2
|
31.6
|
1.0
|
C
|
A:PHE174
|
4.3
|
25.2
|
1.0
|
CB
|
A:PHE174
|
4.4
|
27.2
|
1.0
|
O
|
A:ALA175
|
4.8
|
26.7
|
1.0
|
|
Chlorine binding site 4 out
of 7 in 6hzw
Go back to
Chlorine Binding Sites List in 6hzw
Chlorine binding site 4 out
of 7 in the The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl405
b:32.2
occ:1.00
|
O
|
B:HOH595
|
2.6
|
28.0
|
1.0
|
NH1
|
B:ARG85
|
3.4
|
32.2
|
1.0
|
N
|
B:ARG85
|
3.4
|
34.4
|
1.0
|
N
|
B:PHE78
|
3.4
|
25.4
|
1.0
|
CD2
|
B:PHE78
|
3.6
|
44.9
|
1.0
|
CG
|
B:ARG85
|
3.9
|
35.9
|
1.0
|
CA
|
B:ALA84
|
3.9
|
39.2
|
1.0
|
CB
|
B:PHE78
|
4.0
|
32.6
|
1.0
|
CB
|
B:ARG85
|
4.0
|
36.1
|
1.0
|
CD
|
B:ARG85
|
4.0
|
36.4
|
1.0
|
CA
|
B:ARG77
|
4.1
|
26.1
|
1.0
|
C
|
B:ALA84
|
4.2
|
37.7
|
1.0
|
C
|
B:ARG77
|
4.3
|
25.2
|
1.0
|
CG
|
B:PHE78
|
4.3
|
38.1
|
1.0
|
CA
|
B:PHE78
|
4.3
|
26.3
|
1.0
|
CG2
|
B:VAL81
|
4.3
|
34.4
|
1.0
|
CA
|
B:ARG85
|
4.3
|
37.4
|
1.0
|
CB
|
B:ARG77
|
4.4
|
28.6
|
1.0
|
CB
|
B:ALA84
|
4.4
|
30.6
|
1.0
|
CZ
|
B:ARG85
|
4.5
|
35.3
|
1.0
|
O
|
B:PHE78
|
4.6
|
24.6
|
1.0
|
CE2
|
B:PHE78
|
4.6
|
45.4
|
1.0
|
NE
|
B:ARG85
|
4.7
|
39.5
|
1.0
|
CG
|
B:ARG77
|
4.8
|
29.0
|
1.0
|
C
|
B:PHE78
|
4.9
|
26.0
|
1.0
|
O
|
B:ILE76
|
5.0
|
29.2
|
1.0
|
|
Chlorine binding site 5 out
of 7 in 6hzw
Go back to
Chlorine Binding Sites List in 6hzw
Chlorine binding site 5 out
of 7 in the The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl406
b:33.0
occ:1.00
|
O
|
C:HOH577
|
2.7
|
35.9
|
1.0
|
N
|
C:ARG85
|
3.4
|
36.9
|
1.0
|
N
|
C:PHE78
|
3.4
|
27.4
|
1.0
|
NH1
|
C:ARG85
|
3.5
|
33.1
|
1.0
|
CD2
|
C:PHE78
|
3.6
|
41.0
|
1.0
|
CG
|
C:ARG85
|
3.9
|
32.2
|
1.0
|
CB
|
C:ARG85
|
4.0
|
33.6
|
1.0
|
CB
|
C:PHE78
|
4.0
|
30.7
|
1.0
|
CA
|
C:ALA84
|
4.0
|
32.4
|
1.0
|
CD
|
C:ARG85
|
4.0
|
32.8
|
1.0
|
CA
|
C:ARG77
|
4.1
|
26.7
|
1.0
|
C
|
C:ALA84
|
4.2
|
35.1
|
1.0
|
CA
|
C:PHE78
|
4.3
|
27.9
|
1.0
|
C
|
C:ARG77
|
4.3
|
27.6
|
1.0
|
CG
|
C:PHE78
|
4.3
|
37.4
|
1.0
|
CG2
|
C:VAL81
|
4.3
|
36.5
|
1.0
|
CA
|
C:ARG85
|
4.3
|
34.9
|
1.0
|
CB
|
C:ARG77
|
4.3
|
28.8
|
1.0
|
CB
|
C:ALA84
|
4.5
|
25.4
|
1.0
|
O
|
C:PHE78
|
4.5
|
25.5
|
1.0
|
CZ
|
C:ARG85
|
4.5
|
29.1
|
1.0
|
CE2
|
C:PHE78
|
4.6
|
43.9
|
1.0
|
CG
|
C:ARG77
|
4.7
|
33.2
|
1.0
|
NE
|
C:ARG85
|
4.7
|
33.7
|
1.0
|
O
|
B:HOH550
|
4.9
|
42.2
|
1.0
|
C
|
C:PHE78
|
4.9
|
25.3
|
1.0
|
|
Chlorine binding site 6 out
of 7 in 6hzw
Go back to
Chlorine Binding Sites List in 6hzw
Chlorine binding site 6 out
of 7 in the The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl405
b:30.7
occ:1.00
|
O
|
D:HOH581
|
2.6
|
31.9
|
1.0
|
N
|
D:PHE78
|
3.4
|
28.1
|
1.0
|
N
|
D:ARG85
|
3.5
|
34.9
|
1.0
|
NH1
|
D:ARG85
|
3.5
|
28.2
|
1.0
|
CD2
|
D:PHE78
|
3.7
|
40.2
|
1.0
|
CA
|
D:ALA84
|
3.9
|
33.3
|
1.0
|
CB
|
D:PHE78
|
4.0
|
30.6
|
1.0
|
CG
|
D:ARG85
|
4.0
|
32.6
|
1.0
|
CA
|
D:ARG77
|
4.0
|
26.4
|
1.0
|
CB
|
D:ARG85
|
4.1
|
36.2
|
1.0
|
CD
|
D:ARG85
|
4.1
|
34.9
|
1.0
|
C
|
D:ARG77
|
4.2
|
25.8
|
1.0
|
C
|
D:ALA84
|
4.2
|
34.8
|
1.0
|
CA
|
D:PHE78
|
4.2
|
25.3
|
1.0
|
CB
|
D:ARG77
|
4.3
|
25.7
|
1.0
|
CG
|
D:PHE78
|
4.3
|
34.3
|
1.0
|
CG2
|
D:VAL81
|
4.3
|
30.8
|
1.0
|
CB
|
D:ALA84
|
4.4
|
30.3
|
1.0
|
CA
|
D:ARG85
|
4.4
|
31.9
|
1.0
|
O
|
D:PHE78
|
4.5
|
25.7
|
1.0
|
CZ
|
D:ARG85
|
4.6
|
31.0
|
1.0
|
CG
|
D:ARG77
|
4.6
|
23.8
|
1.0
|
CE2
|
D:PHE78
|
4.7
|
42.5
|
1.0
|
NE
|
D:ARG85
|
4.8
|
35.7
|
1.0
|
C
|
D:PHE78
|
4.9
|
24.1
|
1.0
|
O
|
D:ILE76
|
5.0
|
29.1
|
1.0
|
|
Chlorine binding site 7 out
of 7 in 6hzw
Go back to
Chlorine Binding Sites List in 6hzw
Chlorine binding site 7 out
of 7 in the The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of The Glic Pentameric Ligand-Gated Ion Channel 2.22 Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl405
b:34.5
occ:1.00
|
O
|
E:HOH578
|
2.6
|
38.0
|
1.0
|
NH1
|
E:ARG85
|
3.4
|
45.4
|
1.0
|
N
|
E:PHE78
|
3.4
|
31.0
|
1.0
|
N
|
E:ARG85
|
3.4
|
38.3
|
1.0
|
CD2
|
E:PHE78
|
3.6
|
49.8
|
1.0
|
CG
|
E:ARG85
|
3.9
|
35.7
|
1.0
|
CA
|
E:ALA84
|
4.0
|
38.9
|
1.0
|
CB
|
E:PHE78
|
4.0
|
36.9
|
1.0
|
CB
|
E:ARG85
|
4.0
|
34.9
|
1.0
|
CA
|
E:ARG77
|
4.0
|
25.7
|
1.0
|
CD
|
E:ARG85
|
4.0
|
36.2
|
1.0
|
C
|
E:ARG77
|
4.2
|
27.5
|
1.0
|
C
|
E:ALA84
|
4.2
|
39.1
|
1.0
|
CA
|
E:PHE78
|
4.3
|
32.0
|
1.0
|
CG
|
E:PHE78
|
4.3
|
42.5
|
1.0
|
CB
|
E:ARG77
|
4.3
|
27.0
|
1.0
|
CA
|
E:ARG85
|
4.4
|
35.9
|
1.0
|
CG2
|
E:VAL81
|
4.4
|
39.6
|
1.0
|
CB
|
E:ALA84
|
4.5
|
32.2
|
1.0
|
CZ
|
E:ARG85
|
4.5
|
39.9
|
1.0
|
O
|
E:PHE78
|
4.5
|
28.6
|
1.0
|
CE2
|
E:PHE78
|
4.6
|
52.0
|
1.0
|
CG
|
E:ARG77
|
4.6
|
30.1
|
1.0
|
NE
|
E:ARG85
|
4.7
|
40.0
|
1.0
|
C
|
E:PHE78
|
4.9
|
29.5
|
1.0
|
O
|
E:ILE76
|
4.9
|
25.1
|
1.0
|
|
Reference:
H.Hu,
K.Ataka,
A.Menny,
Z.Fourati,
L.Sauguet,
P.J.Corringer,
P.Koehl,
J.Heberle,
M.Delarue.
Electrostatics, Proton Sensor, and Networks Governing the Gating Transition in Glic, A Proton-Gated Pentameric Ion Channel. Proc. Natl. Acad. Sci. V. 115 12172 2018U.S.A..
ISSN: ESSN 1091-6490
PubMed: 30541892
DOI: 10.1073/PNAS.1813378116
Page generated: Sun Jul 28 01:28:55 2024
|