Calcium in PDB 8tr2: MGLUR3 in the Presence of the Agonist LY379268
Calcium Binding Sites:
The binding sites of Calcium atom in the MGLUR3 in the Presence of the Agonist LY379268
(pdb code 8tr2). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 4 binding sites of Calcium where determined in the
MGLUR3 in the Presence of the Agonist LY379268, PDB code: 8tr2:
Jump to Calcium binding site number:
1;
2;
3;
4;
Calcium binding site 1 out
of 4 in 8tr2
Go back to
Calcium Binding Sites List in 8tr2
Calcium binding site 1 out
of 4 in the MGLUR3 in the Presence of the Agonist LY379268
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of MGLUR3 in the Presence of the Agonist LY379268 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1002
b:63.4
occ:1.00
|
OG1
|
A:THR98
|
3.0
|
37.5
|
1.0
|
N
|
A:SER149
|
3.6
|
26.5
|
1.0
|
CG1
|
A:VAL153
|
3.8
|
28.4
|
1.0
|
CG2
|
A:VAL153
|
3.8
|
28.4
|
1.0
|
N
|
A:TYR150
|
3.8
|
29.3
|
1.0
|
CB
|
A:VAL153
|
3.9
|
28.4
|
1.0
|
CB
|
A:THR98
|
3.9
|
37.5
|
1.0
|
CD2
|
A:TYR150
|
4.0
|
29.3
|
1.0
|
CB
|
A:PRO46
|
4.0
|
34.1
|
1.0
|
CD
|
A:PRO46
|
4.1
|
34.1
|
1.0
|
CG2
|
A:THR98
|
4.2
|
37.5
|
1.0
|
CG
|
A:PRO46
|
4.2
|
34.1
|
1.0
|
CA
|
A:GLY148
|
4.3
|
21.9
|
1.0
|
N
|
A:PRO46
|
4.3
|
34.1
|
1.0
|
CB
|
A:SER149
|
4.3
|
26.5
|
1.0
|
CA
|
A:SER149
|
4.3
|
26.5
|
1.0
|
C
|
A:GLY148
|
4.4
|
21.9
|
1.0
|
CB
|
A:TYR150
|
4.4
|
29.3
|
1.0
|
CA
|
A:PRO46
|
4.6
|
34.1
|
1.0
|
C
|
A:SER149
|
4.6
|
26.5
|
1.0
|
CG
|
A:TYR150
|
4.7
|
29.3
|
1.0
|
CA
|
A:TYR150
|
4.7
|
29.3
|
1.0
|
C
|
A:PHE45
|
4.8
|
29.3
|
1.0
|
OG
|
A:SER149
|
4.8
|
26.5
|
1.0
|
CA
|
A:SER100
|
4.8
|
39.8
|
1.0
|
CE2
|
A:TYR150
|
4.9
|
29.3
|
1.0
|
|
Calcium binding site 2 out
of 4 in 8tr2
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Calcium Binding Sites List in 8tr2
Calcium binding site 2 out
of 4 in the MGLUR3 in the Presence of the Agonist LY379268
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of MGLUR3 in the Presence of the Agonist LY379268 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1003
b:62.5
occ:1.00
|
NH1
|
A:ARG277
|
3.4
|
34.8
|
1.0
|
OG
|
A:SER152
|
3.6
|
30.7
|
1.0
|
N
|
A:SER152
|
3.8
|
30.7
|
1.0
|
CB
|
A:TYR222
|
3.8
|
29.5
|
1.0
|
N
|
A:TYR222
|
3.8
|
29.5
|
1.0
|
N
|
A:SER151
|
4.0
|
31.6
|
1.0
|
N
|
A:ASP221
|
4.1
|
43.7
|
1.0
|
CB
|
A:SER152
|
4.1
|
30.7
|
1.0
|
CD
|
A:ARG277
|
4.1
|
34.8
|
1.0
|
CB
|
A:SER151
|
4.3
|
31.6
|
1.0
|
CZ
|
A:ARG277
|
4.4
|
34.8
|
1.0
|
CA
|
A:TYR222
|
4.5
|
29.5
|
1.0
|
CG
|
A:ARG277
|
4.5
|
34.8
|
1.0
|
CA
|
A:SER151
|
4.5
|
31.6
|
1.0
|
CB
|
A:TYR150
|
4.6
|
29.3
|
1.0
|
CD1
|
A:TYR150
|
4.6
|
29.3
|
1.0
|
CA
|
A:SER152
|
4.6
|
30.7
|
1.0
|
CA
|
A:GLY220
|
4.6
|
49.1
|
1.0
|
C
|
A:SER151
|
4.6
|
31.6
|
1.0
|
NE
|
A:ARG277
|
4.7
|
34.8
|
1.0
|
C
|
A:TYR150
|
4.8
|
29.3
|
1.0
|
C
|
A:ASP221
|
4.9
|
43.7
|
1.0
|
C
|
A:GLY220
|
4.9
|
49.1
|
1.0
|
O
|
A:GLU219
|
4.9
|
50.2
|
1.0
|
O4
|
A:JIX1001
|
4.9
|
30.2
|
1.0
|
CA
|
A:ASP221
|
4.9
|
43.7
|
1.0
|
CG
|
A:TYR222
|
5.0
|
29.5
|
1.0
|
CA
|
A:TYR150
|
5.0
|
29.3
|
1.0
|
|
Calcium binding site 3 out
of 4 in 8tr2
Go back to
Calcium Binding Sites List in 8tr2
Calcium binding site 3 out
of 4 in the MGLUR3 in the Presence of the Agonist LY379268
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of MGLUR3 in the Presence of the Agonist LY379268 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1002
b:61.1
occ:1.00
|
NH1
|
B:ARG277
|
3.4
|
34.8
|
1.0
|
OG
|
B:SER152
|
3.6
|
30.7
|
1.0
|
N
|
B:SER152
|
3.8
|
30.7
|
1.0
|
CB
|
B:TYR222
|
3.8
|
29.5
|
1.0
|
N
|
B:TYR222
|
3.9
|
29.5
|
1.0
|
N
|
B:SER151
|
4.0
|
31.6
|
1.0
|
N
|
B:ASP221
|
4.1
|
43.7
|
1.0
|
CB
|
B:SER152
|
4.1
|
30.7
|
1.0
|
CD
|
B:ARG277
|
4.1
|
34.8
|
1.0
|
CB
|
B:SER151
|
4.3
|
31.6
|
1.0
|
CZ
|
B:ARG277
|
4.4
|
34.8
|
1.0
|
CG
|
B:ARG277
|
4.5
|
34.8
|
1.0
|
CA
|
B:TYR222
|
4.5
|
29.5
|
1.0
|
CA
|
B:SER151
|
4.5
|
31.6
|
1.0
|
CB
|
B:TYR150
|
4.5
|
29.3
|
1.0
|
CD1
|
B:TYR150
|
4.6
|
29.3
|
1.0
|
CA
|
B:SER152
|
4.6
|
30.7
|
1.0
|
CA
|
B:GLY220
|
4.6
|
49.1
|
1.0
|
C
|
B:SER151
|
4.6
|
31.6
|
1.0
|
NE
|
B:ARG277
|
4.7
|
34.8
|
1.0
|
C
|
B:TYR150
|
4.8
|
29.3
|
1.0
|
C
|
B:GLY220
|
4.9
|
49.1
|
1.0
|
C
|
B:ASP221
|
4.9
|
43.7
|
1.0
|
O
|
B:GLU219
|
4.9
|
50.2
|
1.0
|
O4
|
B:JIX1001
|
4.9
|
30.2
|
1.0
|
CA
|
B:ASP221
|
4.9
|
43.7
|
1.0
|
CA
|
B:TYR150
|
5.0
|
29.3
|
1.0
|
CG
|
B:TYR222
|
5.0
|
29.5
|
1.0
|
|
Calcium binding site 4 out
of 4 in 8tr2
Go back to
Calcium Binding Sites List in 8tr2
Calcium binding site 4 out
of 4 in the MGLUR3 in the Presence of the Agonist LY379268
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of MGLUR3 in the Presence of the Agonist LY379268 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1003
b:62.8
occ:1.00
|
OG1
|
B:THR98
|
3.0
|
37.5
|
1.0
|
N
|
B:SER149
|
3.6
|
26.5
|
1.0
|
CG1
|
B:VAL153
|
3.8
|
28.4
|
1.0
|
CG2
|
B:VAL153
|
3.8
|
28.4
|
1.0
|
N
|
B:TYR150
|
3.8
|
29.3
|
1.0
|
CB
|
B:THR98
|
3.9
|
37.5
|
1.0
|
CB
|
B:VAL153
|
3.9
|
28.4
|
1.0
|
CD2
|
B:TYR150
|
4.0
|
29.3
|
1.0
|
CB
|
B:PRO46
|
4.0
|
34.1
|
1.0
|
CD
|
B:PRO46
|
4.1
|
34.1
|
1.0
|
CG2
|
B:THR98
|
4.1
|
37.5
|
1.0
|
CG
|
B:PRO46
|
4.2
|
34.1
|
1.0
|
CA
|
B:GLY148
|
4.3
|
21.9
|
1.0
|
N
|
B:PRO46
|
4.3
|
34.1
|
1.0
|
CB
|
B:SER149
|
4.3
|
26.5
|
1.0
|
CA
|
B:SER149
|
4.3
|
26.5
|
1.0
|
C
|
B:GLY148
|
4.4
|
21.9
|
1.0
|
CB
|
B:TYR150
|
4.4
|
29.3
|
1.0
|
CA
|
B:PRO46
|
4.5
|
34.1
|
1.0
|
C
|
B:SER149
|
4.6
|
26.5
|
1.0
|
CG
|
B:TYR150
|
4.7
|
29.3
|
1.0
|
CA
|
B:TYR150
|
4.7
|
29.3
|
1.0
|
C
|
B:PHE45
|
4.8
|
29.3
|
1.0
|
OG
|
B:SER149
|
4.8
|
26.5
|
1.0
|
CA
|
B:SER100
|
4.8
|
39.8
|
1.0
|
CE2
|
B:TYR150
|
4.9
|
29.3
|
1.0
|
|
Reference:
A.Strauss,
A.J.Gonzalez-Hernandez,
J.Lee,
N.Abreu,
P.Selvakumar,
L.Salas-Estrada,
M.Kristt,
D.C.Marx,
K.Gilliland,
B.J.Melancon,
M.Filizola,
J.Meyerson,
J.Levitz.
Structural Basis of Allosteric Modulation of Metabotropic Glutamate Receptor Activation and Desensitization. Biorxiv 2023.
ISSN: ISSN 2692-8205
PubMed: 37645747
DOI: 10.1101/2023.08.13.552748
Page generated: Sat Sep 28 09:09:02 2024
|