Chlorine in PDB 6hup: Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38.
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38.
(pdb code 6hup). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the
Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38., PDB code: 6hup:
Jump to Chlorine binding site number:
1;
2;
3;
Chlorine binding site 1 out
of 3 in 6hup
Go back to
Chlorine Binding Sites List in 6hup
Chlorine binding site 1 out
of 3 in the Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38.
 Mono view
 Stereo pair view
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A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl502
b:89.1
occ:1.00
|
CL
|
B:DZP502
|
0.0
|
89.1
|
1.0
|
C9
|
B:DZP502
|
1.7
|
89.1
|
1.0
|
C8
|
B:DZP502
|
2.7
|
89.1
|
1.0
|
C14
|
B:DZP502
|
2.7
|
89.1
|
1.0
|
O
|
B:MET261
|
3.0
|
90.1
|
1.0
|
CB
|
B:MET261
|
3.5
|
90.1
|
1.0
|
CE
|
B:MET261
|
3.5
|
90.1
|
1.0
|
C
|
B:MET261
|
3.5
|
90.1
|
1.0
|
O
|
B:LEU285
|
3.8
|
90.4
|
1.0
|
CA
|
B:MET261
|
3.9
|
90.1
|
1.0
|
C7
|
B:DZP502
|
4.0
|
89.1
|
1.0
|
C13
|
B:DZP502
|
4.0
|
89.1
|
1.0
|
CB
|
B:PHE289
|
4.2
|
86.5
|
1.0
|
CB
|
B:ASN265
|
4.3
|
96.2
|
1.0
|
CB
|
B:LEU285
|
4.3
|
90.4
|
1.0
|
CG
|
B:MET261
|
4.4
|
90.1
|
1.0
|
CD1
|
B:PHE289
|
4.4
|
86.5
|
1.0
|
SD
|
B:MET261
|
4.4
|
90.1
|
1.0
|
N
|
B:THR262
|
4.5
|
93.2
|
1.0
|
C6
|
B:DZP502
|
4.5
|
89.1
|
1.0
|
CD2
|
B:LEU285
|
4.5
|
90.4
|
1.0
|
C
|
B:LEU285
|
4.5
|
90.4
|
1.0
|
CG
|
B:PHE289
|
4.6
|
86.5
|
1.0
|
N
|
B:ASN265
|
4.8
|
96.2
|
1.0
|
CG
|
B:ASN265
|
4.8
|
96.2
|
1.0
|
CA
|
B:LEU285
|
4.9
|
90.4
|
1.0
|
ND2
|
B:ASN265
|
4.9
|
96.2
|
1.0
|
CG
|
B:LEU285
|
5.0
|
90.4
|
1.0
|
CA
|
B:THR262
|
5.0
|
93.2
|
1.0
|
|
Chlorine binding site 2 out
of 3 in 6hup
Go back to
Chlorine Binding Sites List in 6hup
Chlorine binding site 2 out
of 3 in the Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38.
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl2001
b:72.0
occ:1.00
|
CL
|
D:DZP2001
|
0.0
|
72.0
|
1.0
|
C9
|
D:DZP2001
|
1.7
|
72.0
|
1.0
|
C8
|
D:DZP2001
|
2.7
|
72.0
|
1.0
|
C14
|
D:DZP2001
|
2.7
|
72.0
|
1.0
|
ND1
|
D:HIS102
|
3.4
|
63.7
|
1.0
|
CB
|
D:HIS102
|
3.4
|
63.7
|
1.0
|
ND2
|
C:ASN60
|
3.7
|
66.3
|
1.0
|
CG
|
D:HIS102
|
3.8
|
63.7
|
1.0
|
O
|
D:HIS102
|
3.8
|
63.7
|
1.0
|
CZ
|
C:PHE77
|
3.9
|
65.5
|
1.0
|
CA
|
D:HIS102
|
3.9
|
63.7
|
1.0
|
C7
|
D:DZP2001
|
4.0
|
72.0
|
1.0
|
C13
|
D:DZP2001
|
4.0
|
72.0
|
1.0
|
C
|
D:HIS102
|
4.1
|
63.7
|
1.0
|
CE2
|
C:PHE77
|
4.3
|
65.5
|
1.0
|
CG
|
C:ASN60
|
4.4
|
66.3
|
1.0
|
C6
|
D:DZP2001
|
4.5
|
72.0
|
1.0
|
CE1
|
D:HIS102
|
4.5
|
63.7
|
1.0
|
OD1
|
C:ASN60
|
4.7
|
66.3
|
1.0
|
CE1
|
C:PHE77
|
5.0
|
65.5
|
1.0
|
|
Chlorine binding site 3 out
of 3 in 6hup
Go back to
Chlorine Binding Sites List in 6hup
Chlorine binding site 3 out
of 3 in the Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38.
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Cryoem Structure of Human Full-Length ALPHA1BETA3GAMMA2L Gaba(A)R in Complex with Diazepam (Valium), Gaba and Megabody MB38. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl502
b:86.2
occ:1.00
|
CL
|
E:DZP502
|
0.0
|
86.2
|
1.0
|
C9
|
E:DZP502
|
1.7
|
86.2
|
1.0
|
C8
|
E:DZP502
|
2.7
|
86.2
|
1.0
|
C14
|
E:DZP502
|
2.7
|
86.2
|
1.0
|
O
|
E:MET261
|
3.0
|
79.0
|
1.0
|
CB
|
E:MET261
|
3.5
|
79.0
|
1.0
|
C
|
E:MET261
|
3.5
|
79.0
|
1.0
|
CE
|
E:MET261
|
3.7
|
79.0
|
1.0
|
O
|
E:LEU285
|
3.8
|
81.1
|
1.0
|
CB
|
E:ASN265
|
3.9
|
84.2
|
1.0
|
CB
|
E:PHE289
|
3.9
|
81.2
|
1.0
|
CA
|
E:MET261
|
3.9
|
79.0
|
1.0
|
C7
|
E:DZP502
|
4.0
|
86.2
|
1.0
|
C13
|
E:DZP502
|
4.0
|
86.2
|
1.0
|
CD1
|
E:PHE289
|
4.1
|
81.2
|
1.0
|
CG
|
E:PHE289
|
4.3
|
81.2
|
1.0
|
CB
|
E:LEU285
|
4.3
|
81.1
|
1.0
|
N
|
E:THR262
|
4.4
|
81.8
|
1.0
|
ND2
|
E:ASN265
|
4.4
|
84.2
|
1.0
|
CG
|
E:ASN265
|
4.5
|
84.2
|
1.0
|
C6
|
E:DZP502
|
4.5
|
86.2
|
1.0
|
CG
|
E:MET261
|
4.5
|
79.0
|
1.0
|
C
|
E:LEU285
|
4.5
|
81.1
|
1.0
|
CD2
|
E:LEU285
|
4.7
|
81.1
|
1.0
|
SD
|
E:MET261
|
4.7
|
79.0
|
1.0
|
N
|
E:ASN265
|
4.8
|
84.2
|
1.0
|
CA
|
E:PHE289
|
4.8
|
81.2
|
1.0
|
CA
|
E:LEU285
|
4.8
|
81.1
|
1.0
|
CA
|
E:THR262
|
4.9
|
81.8
|
1.0
|
CA
|
E:ASN265
|
4.9
|
84.2
|
1.0
|
CG
|
E:LEU285
|
4.9
|
81.1
|
1.0
|
CD1
|
E:LEU285
|
4.9
|
81.1
|
1.0
|
N
|
E:PHE289
|
5.0
|
81.2
|
1.0
|
|
Reference:
S.Masiulis,
R.Desai,
T.Uchanski,
I.Serna Martin,
D.Laverty,
D.Karia,
T.Malinauskas,
J.Zivanov,
E.Pardon,
A.Kotecha,
J.Steyaert,
K.W.Miller,
A.R.Aricescu.
Gabaareceptor Signalling Mechanisms Revealed By Structural Pharmacology. Nature V. 565 454 2019.
ISSN: ISSN 0028-0836
PubMed: 30602790
DOI: 10.1038/S41586-018-0832-5
Page generated: Sun Jul 28 01:14:13 2024
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