Calcium in PDB 4m1l: Complex of Iqcg and CA2+-Bound Cam
Protein crystallography data
The structure of Complex of Iqcg and CA2+-Bound Cam, PDB code: 4m1l
was solved by
W.X.Liang,
L.T.Chen,
Z.Chen,
S.J.Chen,
S.Chen,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
27.64 /
2.10
|
Space group
|
P 32 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
40.491,
40.491,
179.689,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
18.7 /
22.8
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Complex of Iqcg and CA2+-Bound Cam
(pdb code 4m1l). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 4 binding sites of Calcium where determined in the
Complex of Iqcg and CA2+-Bound Cam, PDB code: 4m1l:
Jump to Calcium binding site number:
1;
2;
3;
4;
Calcium binding site 1 out
of 4 in 4m1l
Go back to
Calcium Binding Sites List in 4m1l
Calcium binding site 1 out
of 4 in the Complex of Iqcg and CA2+-Bound Cam
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Complex of Iqcg and CA2+-Bound Cam within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca201
b:22.3
occ:1.00
|
O
|
A:THR27
|
2.3
|
28.3
|
1.0
|
OD1
|
A:ASP21
|
2.3
|
24.8
|
1.0
|
OD1
|
A:ASP25
|
2.4
|
27.6
|
1.0
|
OD1
|
A:ASP23
|
2.4
|
26.5
|
1.0
|
OE2
|
A:GLU32
|
2.4
|
26.8
|
1.0
|
O
|
A:HOH318
|
2.5
|
21.4
|
1.0
|
OE1
|
A:GLU32
|
2.7
|
27.6
|
1.0
|
CD
|
A:GLU32
|
2.9
|
24.9
|
1.0
|
CG
|
A:ASP25
|
3.2
|
34.3
|
1.0
|
CG
|
A:ASP23
|
3.2
|
31.9
|
1.0
|
OD2
|
A:ASP23
|
3.5
|
34.6
|
1.0
|
CG
|
A:ASP21
|
3.5
|
25.2
|
1.0
|
C
|
A:THR27
|
3.5
|
24.4
|
1.0
|
OD2
|
A:ASP25
|
3.7
|
37.5
|
1.0
|
OG1
|
A:THR27
|
4.1
|
43.8
|
1.0
|
N
|
A:THR27
|
4.1
|
21.7
|
1.0
|
N
|
A:ASP25
|
4.2
|
31.2
|
1.0
|
OD2
|
A:ASP21
|
4.3
|
27.1
|
1.0
|
CA
|
A:ASP21
|
4.3
|
21.4
|
1.0
|
CA
|
A:THR27
|
4.3
|
27.9
|
1.0
|
CB
|
A:ASP21
|
4.4
|
21.4
|
1.0
|
CB
|
A:ASP25
|
4.4
|
34.9
|
1.0
|
CG
|
A:GLU32
|
4.4
|
21.5
|
1.0
|
N
|
A:ASP23
|
4.4
|
29.4
|
1.0
|
N
|
A:ILE28
|
4.5
|
16.6
|
1.0
|
C
|
A:ASP21
|
4.6
|
22.9
|
1.0
|
N
|
A:GLY24
|
4.6
|
28.8
|
1.0
|
CB
|
A:ASP23
|
4.6
|
32.1
|
1.0
|
CA
|
A:ILE28
|
4.6
|
14.9
|
1.0
|
O4
|
A:SO4205
|
4.6
|
52.0
|
1.0
|
N
|
A:LYS22
|
4.7
|
27.0
|
1.0
|
CA
|
A:ASP25
|
4.7
|
34.0
|
1.0
|
O
|
A:HOH321
|
4.7
|
31.0
|
1.0
|
N
|
A:GLY26
|
4.8
|
27.6
|
1.0
|
CB
|
A:THR27
|
4.8
|
38.6
|
1.0
|
CA
|
A:ASP23
|
4.9
|
31.9
|
1.0
|
N
|
A:THR29
|
4.9
|
19.5
|
1.0
|
CG2
|
A:THR29
|
4.9
|
21.3
|
1.0
|
C
|
A:ASP25
|
4.9
|
32.7
|
1.0
|
C
|
A:ASP23
|
5.0
|
32.0
|
1.0
|
|
Calcium binding site 2 out
of 4 in 4m1l
Go back to
Calcium Binding Sites List in 4m1l
Calcium binding site 2 out
of 4 in the Complex of Iqcg and CA2+-Bound Cam
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Complex of Iqcg and CA2+-Bound Cam within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca202
b:31.1
occ:1.00
|
OD1
|
A:ASP57
|
2.3
|
36.9
|
1.0
|
OD1
|
A:ASN61
|
2.3
|
39.0
|
1.0
|
O
|
A:THR63
|
2.4
|
27.3
|
1.0
|
O
|
A:HOH356
|
2.4
|
46.6
|
1.0
|
OE2
|
A:GLU68
|
2.4
|
30.4
|
1.0
|
OD1
|
A:ASP59
|
2.5
|
47.1
|
1.0
|
OE1
|
A:GLU68
|
2.5
|
28.8
|
1.0
|
CD
|
A:GLU68
|
2.8
|
29.5
|
1.0
|
CG
|
A:ASN61
|
3.3
|
42.9
|
1.0
|
CG
|
A:ASP59
|
3.3
|
52.7
|
1.0
|
CG
|
A:ASP57
|
3.4
|
40.1
|
1.0
|
OD2
|
A:ASP59
|
3.6
|
55.3
|
1.0
|
C
|
A:THR63
|
3.6
|
25.9
|
1.0
|
ND2
|
A:ASN61
|
3.7
|
44.9
|
1.0
|
OD2
|
A:ASP57
|
4.2
|
41.0
|
1.0
|
CG
|
A:GLU68
|
4.3
|
27.5
|
1.0
|
N
|
A:THR63
|
4.4
|
34.2
|
1.0
|
CA
|
A:ILE64
|
4.4
|
23.6
|
1.0
|
CA
|
A:ASP57
|
4.4
|
39.8
|
1.0
|
N
|
A:ILE64
|
4.4
|
24.1
|
1.0
|
CB
|
A:ASP57
|
4.4
|
39.3
|
1.0
|
N
|
A:ASN61
|
4.4
|
42.5
|
1.0
|
N
|
A:ASP65
|
4.4
|
22.1
|
1.0
|
CB
|
A:ASN61
|
4.5
|
44.0
|
1.0
|
N
|
A:ASP59
|
4.5
|
49.6
|
1.0
|
CA
|
A:THR63
|
4.5
|
29.0
|
1.0
|
OG1
|
A:THR63
|
4.5
|
29.0
|
1.0
|
C
|
A:ASP57
|
4.6
|
43.5
|
1.0
|
CB
|
A:ASP59
|
4.6
|
53.1
|
1.0
|
N
|
A:ALA58
|
4.7
|
44.8
|
1.0
|
CG
|
A:ASP65
|
4.8
|
40.3
|
1.0
|
N
|
A:GLY60
|
4.8
|
45.9
|
1.0
|
C
|
A:ILE64
|
4.9
|
20.7
|
1.0
|
CA
|
A:ASN61
|
4.9
|
40.6
|
1.0
|
OD1
|
A:ASP65
|
4.9
|
41.3
|
1.0
|
OD2
|
A:ASP65
|
4.9
|
45.6
|
1.0
|
CA
|
A:ASP59
|
4.9
|
51.9
|
1.0
|
N
|
A:GLY62
|
4.9
|
32.6
|
1.0
|
|
Calcium binding site 3 out
of 4 in 4m1l
Go back to
Calcium Binding Sites List in 4m1l
Calcium binding site 3 out
of 4 in the Complex of Iqcg and CA2+-Bound Cam
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Complex of Iqcg and CA2+-Bound Cam within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca203
b:20.1
occ:1.00
|
O
|
A:TYR100
|
2.3
|
20.9
|
1.0
|
OD1
|
A:ASP94
|
2.4
|
21.0
|
1.0
|
OD1
|
A:ASN98
|
2.4
|
15.4
|
1.0
|
OD1
|
A:ASP96
|
2.4
|
31.2
|
1.0
|
O
|
A:HOH317
|
2.4
|
30.3
|
1.0
|
OE2
|
A:GLU105
|
2.5
|
22.2
|
1.0
|
OE1
|
A:GLU105
|
2.5
|
21.2
|
1.0
|
CD
|
A:GLU105
|
2.9
|
20.5
|
1.0
|
CG
|
A:ASP96
|
3.3
|
26.9
|
1.0
|
CG
|
A:ASN98
|
3.4
|
18.3
|
1.0
|
C
|
A:TYR100
|
3.5
|
19.2
|
1.0
|
CG
|
A:ASP94
|
3.5
|
23.9
|
1.0
|
OD2
|
A:ASP96
|
3.5
|
27.1
|
1.0
|
ND2
|
A:ASN98
|
4.1
|
16.8
|
1.0
|
N
|
A:TYR100
|
4.1
|
15.7
|
1.0
|
N
|
A:ASN98
|
4.2
|
20.2
|
1.0
|
CA
|
A:ASP94
|
4.2
|
22.8
|
1.0
|
CA
|
A:TYR100
|
4.3
|
17.2
|
1.0
|
CG
|
A:GLU105
|
4.4
|
20.2
|
1.0
|
OD2
|
A:ASP94
|
4.4
|
20.8
|
1.0
|
CB
|
A:ASP94
|
4.4
|
23.7
|
1.0
|
CB
|
A:ASN98
|
4.4
|
19.5
|
1.0
|
N
|
A:ILE101
|
4.5
|
19.8
|
1.0
|
N
|
A:ASP96
|
4.5
|
24.1
|
1.0
|
N
|
A:GLY97
|
4.5
|
24.4
|
1.0
|
CA
|
A:ILE101
|
4.6
|
17.0
|
1.0
|
C
|
A:ASP94
|
4.6
|
23.9
|
1.0
|
CB
|
A:ASP96
|
4.6
|
26.7
|
1.0
|
CA
|
A:ASN98
|
4.7
|
21.7
|
1.0
|
N
|
A:GLY99
|
4.8
|
19.9
|
1.0
|
N
|
A:LYS95
|
4.8
|
28.9
|
1.0
|
N
|
A:SER102
|
4.8
|
18.8
|
1.0
|
CB
|
A:TYR100
|
4.8
|
13.6
|
1.0
|
CA
|
A:ASP96
|
4.9
|
26.2
|
1.0
|
C
|
A:ASP96
|
5.0
|
26.5
|
1.0
|
C
|
A:ASN98
|
5.0
|
21.5
|
1.0
|
|
Calcium binding site 4 out
of 4 in 4m1l
Go back to
Calcium Binding Sites List in 4m1l
Calcium binding site 4 out
of 4 in the Complex of Iqcg and CA2+-Bound Cam
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Complex of Iqcg and CA2+-Bound Cam within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca204
b:16.4
occ:1.00
|
OD1
|
A:ASP130
|
2.3
|
16.8
|
1.0
|
OD1
|
A:ASP134
|
2.3
|
19.9
|
1.0
|
O
|
A:HOH316
|
2.4
|
16.2
|
1.0
|
O
|
A:GLN136
|
2.4
|
18.7
|
1.0
|
OD1
|
A:ASP132
|
2.4
|
21.2
|
1.0
|
OE2
|
A:GLU141
|
2.5
|
18.0
|
1.0
|
OE1
|
A:GLU141
|
2.5
|
16.2
|
1.0
|
CD
|
A:GLU141
|
2.8
|
14.6
|
1.0
|
CG
|
A:ASP132
|
3.2
|
28.2
|
1.0
|
CG
|
A:ASP134
|
3.2
|
22.2
|
1.0
|
CG
|
A:ASP130
|
3.4
|
17.6
|
1.0
|
OD2
|
A:ASP132
|
3.4
|
29.2
|
1.0
|
C
|
A:GLN136
|
3.5
|
17.8
|
1.0
|
OD2
|
A:ASP134
|
3.6
|
21.1
|
1.0
|
OD2
|
A:ASP130
|
4.1
|
16.8
|
1.0
|
N
|
A:ASP134
|
4.1
|
18.0
|
1.0
|
N
|
A:ASP132
|
4.2
|
18.5
|
1.0
|
N
|
A:GLN136
|
4.2
|
14.5
|
1.0
|
N
|
A:ILE131
|
4.2
|
13.6
|
1.0
|
CG
|
A:GLU141
|
4.3
|
13.3
|
1.0
|
N
|
A:GLY133
|
4.4
|
15.3
|
1.0
|
N
|
A:VAL137
|
4.4
|
15.5
|
1.0
|
CB
|
A:ASP134
|
4.4
|
22.9
|
1.0
|
CB
|
A:ASP130
|
4.4
|
14.3
|
1.0
|
CA
|
A:GLN136
|
4.4
|
14.6
|
1.0
|
CA
|
A:ASP130
|
4.4
|
15.3
|
1.0
|
CA
|
A:VAL137
|
4.4
|
13.6
|
1.0
|
N
|
A:ASN138
|
4.5
|
15.5
|
1.0
|
CB
|
A:ASP132
|
4.5
|
22.5
|
1.0
|
CA
|
A:ASP134
|
4.7
|
20.6
|
1.0
|
CA
|
A:ASP132
|
4.7
|
21.9
|
1.0
|
N
|
A:GLY135
|
4.8
|
15.7
|
1.0
|
C
|
A:ASP130
|
4.8
|
16.2
|
1.0
|
C
|
A:ASP132
|
4.9
|
15.7
|
1.0
|
CB
|
A:GLN136
|
4.9
|
9.8
|
1.0
|
C
|
A:VAL137
|
4.9
|
15.1
|
1.0
|
|
Reference:
L.T.Chen,
W.X.Liang,
S.Chen,
R.K.Li,
J.L.Tan,
P.F.Xu,
L.F.Luo,
L.Wang,
S.H.Yu,
G.Y.Meng,
K.K.Li,
T.X.Liu,
Z.Chen,
S.J.Chen.
Functional and Molecular Features of A Calmodulin-Interacting Protein Iqcg Required For Haematopoiesis in Zebrafish Nat Commun V. 5 3811 2014.
ISSN: ESSN 2041-1723
DOI: 10.1038/NCOMMS4811
Page generated: Sun Jul 14 09:58:54 2024
|