Calcium in PDB 2r28: The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
Enzymatic activity of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
All present enzymatic activity of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide:
3.1.3.16;
Protein crystallography data
The structure of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide, PDB code: 2r28
was solved by
Q.Ye,
J.Zheng,
Z.Jia,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
|
Resolution Low / High (Å)
|
66.67 /
1.86
|
|
Space group
|
C 1 2 1
|
|
Cell size a, b, c (Å), α, β, γ (°)
|
120.700,
43.200,
70.900,
90.00,
109.90,
90.00
|
|
R / Rfree (%)
|
23 /
28
|
Calcium Binding Sites:
The binding sites of Calcium atom in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
(pdb code 2r28). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 8 binding sites of Calcium where determined in the
The Complex Structure of Calmodulin Bound to A Calcineurin Peptide, PDB code: 2r28:
Jump to Calcium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Calcium binding site 1 out
of 8 in 2r28
Go back to
Calcium Binding Sites List in 2r28
Calcium binding site 1 out
of 8 in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
 Mono view
 Stereo pair view
|
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1001
b:26.7
occ:1.00
|
OD2
|
A:ASP21
|
2.2
|
26.8
|
1.0
|
|
OD1
|
A:ASP25
|
2.3
|
29.8
|
1.0
|
|
O
|
A:THR27
|
2.3
|
26.0
|
1.0
|
|
O
|
A:HOH1099
|
2.4
|
37.5
|
1.0
|
|
OD2
|
A:ASP23
|
2.5
|
29.8
|
1.0
|
|
OE1
|
A:GLU32
|
2.7
|
27.5
|
1.0
|
|
OE2
|
A:GLU32
|
2.7
|
31.6
|
1.0
|
|
CD
|
A:GLU32
|
3.0
|
30.1
|
1.0
|
|
CG
|
A:ASP25
|
3.4
|
29.6
|
1.0
|
|
CG
|
A:ASP21
|
3.4
|
28.6
|
1.0
|
|
C
|
A:THR27
|
3.5
|
27.2
|
1.0
|
|
CG
|
A:ASP23
|
3.6
|
34.2
|
1.0
|
|
OD2
|
A:ASP25
|
4.0
|
31.5
|
1.0
|
|
N
|
A:THR27
|
4.1
|
25.9
|
1.0
|
|
OG1
|
A:THR27
|
4.1
|
27.0
|
1.0
|
|
CA
|
A:ASP21
|
4.1
|
28.2
|
1.0
|
|
OD1
|
A:ASP21
|
4.2
|
30.4
|
1.0
|
|
N
|
A:ASP25
|
4.2
|
29.5
|
1.0
|
|
OD1
|
A:ASP23
|
4.2
|
35.3
|
1.0
|
|
CB
|
A:ASP21
|
4.3
|
27.9
|
1.0
|
|
N
|
A:ASP23
|
4.3
|
31.9
|
1.0
|
|
CA
|
A:THR27
|
4.4
|
26.4
|
1.0
|
|
C
|
A:ASP21
|
4.4
|
30.1
|
1.0
|
|
CB
|
A:ASP25
|
4.4
|
29.7
|
1.0
|
|
N
|
A:ILE28
|
4.5
|
24.6
|
1.0
|
|
N
|
A:LYS22
|
4.5
|
31.4
|
1.0
|
|
CA
|
A:ILE28
|
4.5
|
24.2
|
1.0
|
|
N
|
A:GLY24
|
4.5
|
31.6
|
1.0
|
|
CG
|
A:GLU32
|
4.5
|
29.6
|
1.0
|
|
CB
|
A:ASP23
|
4.7
|
32.7
|
1.0
|
|
CA
|
A:ASP25
|
4.8
|
29.5
|
1.0
|
|
N
|
A:GLY26
|
4.8
|
28.0
|
1.0
|
|
CA
|
A:ASP23
|
4.8
|
33.7
|
1.0
|
|
O
|
A:HOH1079
|
4.9
|
35.8
|
1.0
|
|
C
|
A:ASP23
|
4.9
|
33.1
|
1.0
|
|
CB
|
A:THR27
|
4.9
|
27.4
|
1.0
|
|
O
|
A:ASP21
|
4.9
|
30.9
|
1.0
|
|
N
|
A:THR29
|
5.0
|
25.3
|
1.0
|
|
Calcium binding site 2 out
of 8 in 2r28
Go back to
Calcium Binding Sites List in 2r28
Calcium binding site 2 out
of 8 in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
 Mono view
 Stereo pair view
|
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1002
b:30.6
occ:1.00
|
OD2
|
A:ASP57
|
2.1
|
36.7
|
1.0
|
|
O
|
A:THR63
|
2.3
|
25.7
|
1.0
|
|
OE2
|
A:GLU68
|
2.4
|
31.4
|
1.0
|
|
OD1
|
A:ASP59
|
2.4
|
41.7
|
1.0
|
|
OD1
|
A:ASN61
|
2.5
|
35.7
|
1.0
|
|
OE1
|
A:GLU68
|
2.8
|
31.7
|
1.0
|
|
CD
|
A:GLU68
|
2.9
|
31.5
|
1.0
|
|
CG
|
A:ASP57
|
3.3
|
34.6
|
1.0
|
|
CG
|
A:ASP59
|
3.4
|
42.4
|
1.0
|
|
CG
|
A:ASN61
|
3.5
|
36.2
|
1.0
|
|
C
|
A:THR63
|
3.5
|
27.4
|
1.0
|
|
O
|
A:HOH1011
|
3.6
|
31.8
|
1.0
|
|
OD2
|
A:ASP59
|
3.8
|
46.0
|
1.0
|
|
CA
|
A:ASP57
|
4.1
|
35.0
|
1.0
|
|
CB
|
A:ASP57
|
4.1
|
35.3
|
1.0
|
|
ND2
|
A:ASN61
|
4.1
|
36.3
|
1.0
|
|
OD1
|
A:ASP57
|
4.2
|
34.2
|
1.0
|
|
N
|
A:THR63
|
4.3
|
29.2
|
1.0
|
|
N
|
A:ASN61
|
4.3
|
38.9
|
1.0
|
|
N
|
A:ASP59
|
4.4
|
41.3
|
1.0
|
|
N
|
A:ILE64
|
4.4
|
26.9
|
1.0
|
|
CG
|
A:GLU68
|
4.4
|
28.9
|
1.0
|
|
CA
|
A:ILE64
|
4.5
|
26.6
|
1.0
|
|
C
|
A:ASP57
|
4.5
|
36.6
|
1.0
|
|
N
|
A:ASP65
|
4.5
|
26.1
|
1.0
|
|
OG1
|
A:THR63
|
4.5
|
25.8
|
1.0
|
|
CA
|
A:THR63
|
4.5
|
27.1
|
1.0
|
|
N
|
A:GLY60
|
4.5
|
42.0
|
1.0
|
|
CB
|
A:ASN61
|
4.6
|
36.0
|
1.0
|
|
N
|
A:ALA58
|
4.7
|
37.0
|
1.0
|
|
CB
|
A:ASP59
|
4.7
|
42.3
|
1.0
|
|
O
|
A:HOH1054
|
4.7
|
48.7
|
1.0
|
|
N
|
A:GLY62
|
4.8
|
31.2
|
1.0
|
|
CA
|
A:ASN61
|
4.8
|
36.7
|
1.0
|
|
CA
|
A:ASP59
|
4.9
|
41.4
|
1.0
|
|
CG
|
A:ASP65
|
4.9
|
29.9
|
1.0
|
|
OD2
|
A:ASP65
|
4.9
|
32.3
|
1.0
|
|
C
|
A:ILE64
|
4.9
|
26.1
|
1.0
|
|
C
|
A:ASN61
|
4.9
|
35.0
|
1.0
|
|
OD1
|
A:ASP65
|
4.9
|
32.0
|
1.0
|
|
C
|
A:ASP59
|
5.0
|
41.9
|
1.0
|
|
Calcium binding site 3 out
of 8 in 2r28
Go back to
Calcium Binding Sites List in 2r28
Calcium binding site 3 out
of 8 in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
 Mono view
 Stereo pair view
|
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1003
b:23.2
occ:1.00
|
O
|
A:TYR100
|
2.2
|
25.8
|
1.0
|
|
OD2
|
A:ASP94
|
2.3
|
20.5
|
1.0
|
|
ND2
|
A:ASN98
|
2.3
|
19.3
|
1.0
|
|
O
|
A:HOH1005
|
2.4
|
25.0
|
1.0
|
|
OD1
|
A:ASP96
|
2.4
|
28.2
|
1.0
|
|
OE1
|
A:GLU105
|
2.6
|
25.6
|
1.0
|
|
OE2
|
A:GLU105
|
2.6
|
26.6
|
1.0
|
|
CD
|
A:GLU105
|
2.9
|
25.2
|
1.0
|
|
CG
|
A:ASP96
|
3.3
|
27.8
|
1.0
|
|
CG
|
A:ASN98
|
3.4
|
27.6
|
1.0
|
|
CG
|
A:ASP94
|
3.4
|
21.8
|
1.0
|
|
C
|
A:TYR100
|
3.5
|
24.3
|
1.0
|
|
OD2
|
A:ASP96
|
3.6
|
29.8
|
1.0
|
|
OD1
|
A:ASN98
|
4.0
|
30.4
|
1.0
|
|
N
|
A:TYR100
|
4.1
|
23.8
|
1.0
|
|
N
|
A:ASN98
|
4.2
|
28.4
|
1.0
|
|
CA
|
A:ASP94
|
4.2
|
25.1
|
1.0
|
|
OD1
|
A:ASP94
|
4.3
|
25.7
|
1.0
|
|
CB
|
A:ASP94
|
4.3
|
24.0
|
1.0
|
|
CA
|
A:TYR100
|
4.3
|
24.6
|
1.0
|
|
CG
|
A:GLU105
|
4.3
|
25.3
|
1.0
|
|
O
|
A:HOH1006
|
4.4
|
25.2
|
1.0
|
|
N
|
A:ILE101
|
4.4
|
21.7
|
1.0
|
|
C
|
A:ASP94
|
4.5
|
26.4
|
1.0
|
|
N
|
A:ASP96
|
4.5
|
29.4
|
1.0
|
|
CB
|
A:ASN98
|
4.5
|
27.6
|
1.0
|
|
CA
|
A:ILE101
|
4.5
|
21.7
|
1.0
|
|
CB
|
A:ASP96
|
4.6
|
29.2
|
1.0
|
|
N
|
A:GLY97
|
4.6
|
29.6
|
1.0
|
|
N
|
A:SER102
|
4.7
|
20.3
|
1.0
|
|
CB
|
A:TYR100
|
4.7
|
25.0
|
1.0
|
|
CA
|
A:ASN98
|
4.7
|
26.2
|
1.0
|
|
N
|
A:GLY99
|
4.7
|
24.2
|
1.0
|
|
N
|
A:LYS95
|
4.8
|
28.6
|
1.0
|
|
O
|
A:ASP94
|
4.8
|
28.1
|
1.0
|
|
CA
|
A:ASP96
|
4.8
|
29.7
|
1.0
|
|
O
|
A:HOH1018
|
4.9
|
30.8
|
1.0
|
|
C
|
A:ASP96
|
4.9
|
29.2
|
1.0
|
|
O
|
A:HOH1036
|
5.0
|
36.9
|
1.0
|
|
C
|
A:ASN98
|
5.0
|
26.9
|
1.0
|
|
Calcium binding site 4 out
of 8 in 2r28
Go back to
Calcium Binding Sites List in 2r28
Calcium binding site 4 out
of 8 in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
 Mono view
 Stereo pair view
|
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca1004
b:21.5
occ:1.00
|
OD1
|
A:ASP130
|
2.3
|
23.0
|
1.0
|
|
O
|
A:GLN136
|
2.3
|
21.0
|
1.0
|
|
OE2
|
A:GLU141
|
2.4
|
24.2
|
1.0
|
|
OD1
|
A:ASP134
|
2.4
|
19.1
|
1.0
|
|
O
|
A:HOH1055
|
2.5
|
24.7
|
1.0
|
|
OD1
|
A:ASP132
|
2.5
|
26.5
|
1.0
|
|
OE1
|
A:GLU141
|
2.7
|
27.6
|
1.0
|
|
CD
|
A:GLU141
|
2.9
|
27.1
|
1.0
|
|
CG
|
A:ASP134
|
3.3
|
24.7
|
1.0
|
|
CG
|
A:ASP132
|
3.3
|
29.9
|
1.0
|
|
CG
|
A:ASP130
|
3.4
|
21.1
|
1.0
|
|
C
|
A:GLN136
|
3.5
|
21.3
|
1.0
|
|
OD2
|
A:ASP132
|
3.6
|
33.9
|
1.0
|
|
OD2
|
A:ASP134
|
3.7
|
24.6
|
1.0
|
|
N
|
A:ASP134
|
4.1
|
24.2
|
1.0
|
|
CA
|
A:ASP130
|
4.1
|
22.2
|
1.0
|
|
CB
|
A:ASP130
|
4.2
|
21.3
|
1.0
|
|
N
|
A:GLN136
|
4.2
|
20.1
|
1.0
|
|
OD2
|
A:ASP130
|
4.2
|
21.0
|
1.0
|
|
CA
|
A:VAL137
|
4.4
|
21.8
|
1.0
|
|
N
|
A:VAL137
|
4.4
|
20.4
|
1.0
|
|
CG
|
A:GLU141
|
4.4
|
23.2
|
1.0
|
|
N
|
A:ASN138
|
4.4
|
23.0
|
1.0
|
|
N
|
A:ASP132
|
4.4
|
27.9
|
1.0
|
|
CB
|
A:ASP134
|
4.4
|
23.7
|
1.0
|
|
C
|
A:ASP130
|
4.5
|
24.4
|
1.0
|
|
CA
|
A:GLN136
|
4.5
|
21.2
|
1.0
|
|
N
|
A:GLY133
|
4.6
|
27.9
|
1.0
|
|
N
|
A:GLY135
|
4.6
|
21.8
|
1.0
|
|
CB
|
A:ASP132
|
4.6
|
29.4
|
1.0
|
|
CA
|
A:ASP134
|
4.7
|
23.2
|
1.0
|
|
N
|
A:ILE131
|
4.7
|
25.3
|
1.0
|
|
CA
|
A:ASP132
|
4.8
|
30.1
|
1.0
|
|
C
|
A:VAL137
|
4.9
|
22.6
|
1.0
|
|
C
|
A:ASP132
|
4.9
|
29.5
|
1.0
|
|
C
|
A:ASP134
|
4.9
|
22.6
|
1.0
|
|
O
|
A:ASP130
|
5.0
|
23.7
|
1.0
|
|
Calcium binding site 5 out
of 8 in 2r28
Go back to
Calcium Binding Sites List in 2r28
Calcium binding site 5 out
of 8 in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
 Mono view
 Stereo pair view
|
|
A full contact list of Calcium with other atoms in the Ca binding
site number 5 of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1001
b:50.4
occ:1.00
|
OE2
|
B:GLU32
|
2.3
|
43.5
|
1.0
|
|
O
|
B:THR27
|
2.4
|
45.7
|
1.0
|
|
OD2
|
B:ASP21
|
2.6
|
48.3
|
1.0
|
|
OD1
|
B:ASP25
|
2.9
|
58.5
|
1.0
|
|
OD2
|
B:ASP25
|
3.0
|
55.3
|
1.0
|
|
CD
|
B:GLU32
|
3.1
|
44.0
|
1.0
|
|
CG
|
B:ASP25
|
3.2
|
55.1
|
1.0
|
|
OE1
|
B:GLU32
|
3.2
|
43.1
|
1.0
|
|
OD1
|
B:ASP23
|
3.3
|
55.9
|
1.0
|
|
CG
|
B:ASP21
|
3.5
|
46.9
|
1.0
|
|
C
|
B:THR27
|
3.5
|
46.4
|
1.0
|
|
CG
|
B:ASP23
|
4.1
|
54.5
|
1.0
|
|
N
|
B:THR27
|
4.1
|
48.4
|
1.0
|
|
CB
|
B:ASP21
|
4.2
|
46.4
|
1.0
|
|
OD2
|
B:ASP23
|
4.2
|
56.0
|
1.0
|
|
CA
|
B:ASP21
|
4.3
|
46.7
|
1.0
|
|
OD1
|
B:ASP21
|
4.3
|
41.6
|
1.0
|
|
CA
|
B:THR27
|
4.4
|
47.2
|
1.0
|
|
N
|
B:ILE28
|
4.5
|
45.2
|
1.0
|
|
CG
|
B:GLU32
|
4.5
|
44.2
|
1.0
|
|
CB
|
B:ASP25
|
4.5
|
53.2
|
1.0
|
|
N
|
B:ASP25
|
4.5
|
52.8
|
1.0
|
|
N
|
B:GLY26
|
4.6
|
51.7
|
1.0
|
|
CA
|
B:ILE28
|
4.7
|
43.6
|
1.0
|
|
OG1
|
B:THR27
|
4.7
|
47.4
|
1.0
|
|
C
|
B:ASP21
|
4.9
|
47.7
|
1.0
|
|
CA
|
B:ASP25
|
4.9
|
53.0
|
1.0
|
|
Calcium binding site 6 out
of 8 in 2r28
Go back to
Calcium Binding Sites List in 2r28
Calcium binding site 6 out
of 8 in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
 Mono view
 Stereo pair view
|
|
A full contact list of Calcium with other atoms in the Ca binding
site number 6 of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1002
b:42.6
occ:1.00
|
OD2
|
B:ASP57
|
2.0
|
43.5
|
1.0
|
|
OE2
|
B:GLU68
|
2.3
|
34.3
|
1.0
|
|
O
|
B:THR63
|
2.4
|
42.6
|
1.0
|
|
OD1
|
B:ASN61
|
2.5
|
41.0
|
1.0
|
|
OE1
|
B:GLU68
|
2.6
|
37.3
|
1.0
|
|
OD1
|
B:ASP59
|
2.6
|
53.7
|
1.0
|
|
CD
|
B:GLU68
|
2.8
|
34.2
|
1.0
|
|
CG
|
B:ASP57
|
3.2
|
43.3
|
1.0
|
|
CG
|
B:ASP59
|
3.3
|
51.8
|
1.0
|
|
OD2
|
B:ASP59
|
3.4
|
53.2
|
1.0
|
|
C
|
B:THR63
|
3.5
|
42.2
|
1.0
|
|
CG
|
B:ASN61
|
3.6
|
44.9
|
1.0
|
|
OD1
|
B:ASP57
|
4.0
|
47.5
|
1.0
|
|
ND2
|
B:ASN61
|
4.1
|
42.1
|
1.0
|
|
CB
|
B:ASP57
|
4.2
|
43.4
|
1.0
|
|
O
|
B:HOH1087
|
4.2
|
50.9
|
1.0
|
|
CA
|
B:ASP57
|
4.2
|
43.3
|
1.0
|
|
N
|
B:THR63
|
4.2
|
43.3
|
1.0
|
|
CG
|
B:GLU68
|
4.3
|
33.7
|
1.0
|
|
N
|
B:ILE64
|
4.4
|
41.8
|
1.0
|
|
CA
|
B:ILE64
|
4.4
|
41.6
|
1.0
|
|
OG1
|
B:THR63
|
4.4
|
41.8
|
1.0
|
|
N
|
B:ASP65
|
4.4
|
40.0
|
1.0
|
|
CA
|
B:THR63
|
4.5
|
42.8
|
1.0
|
|
N
|
B:ASN61
|
4.7
|
46.1
|
1.0
|
|
CB
|
B:ASP59
|
4.7
|
48.9
|
1.0
|
|
C
|
B:ASP57
|
4.8
|
43.6
|
1.0
|
|
N
|
B:ASP59
|
4.8
|
48.5
|
1.0
|
|
OD1
|
B:ASP65
|
4.8
|
42.8
|
1.0
|
|
C
|
B:ILE64
|
4.8
|
41.0
|
1.0
|
|
CB
|
B:ASN61
|
4.9
|
45.0
|
1.0
|
|
CG
|
B:ASP65
|
4.9
|
40.4
|
1.0
|
|
N
|
B:GLY62
|
5.0
|
45.8
|
1.0
|
|
CB
|
B:GLU68
|
5.0
|
32.5
|
1.0
|
|
Calcium binding site 7 out
of 8 in 2r28
Go back to
Calcium Binding Sites List in 2r28
Calcium binding site 7 out
of 8 in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
 Mono view
 Stereo pair view
|
|
A full contact list of Calcium with other atoms in the Ca binding
site number 7 of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1003
b:24.9
occ:1.00
|
O
|
B:TYR100
|
2.2
|
24.2
|
1.0
|
|
OD2
|
B:ASP94
|
2.3
|
27.7
|
1.0
|
|
O
|
B:HOH1034
|
2.4
|
23.8
|
1.0
|
|
OE2
|
B:GLU105
|
2.4
|
27.2
|
1.0
|
|
ND2
|
B:ASN98
|
2.5
|
24.1
|
1.0
|
|
OD1
|
B:ASP96
|
2.5
|
33.3
|
1.0
|
|
OE1
|
B:GLU105
|
2.5
|
29.2
|
1.0
|
|
CD
|
B:GLU105
|
2.8
|
29.4
|
1.0
|
|
CG
|
B:ASP96
|
3.4
|
34.3
|
1.0
|
|
C
|
B:TYR100
|
3.5
|
24.8
|
1.0
|
|
CG
|
B:ASP94
|
3.5
|
27.1
|
1.0
|
|
CG
|
B:ASN98
|
3.5
|
24.9
|
1.0
|
|
OD2
|
B:ASP96
|
3.9
|
34.3
|
1.0
|
|
OD1
|
B:ASN98
|
4.1
|
26.2
|
1.0
|
|
N
|
B:TYR100
|
4.1
|
24.8
|
1.0
|
|
CA
|
B:ASP94
|
4.2
|
27.4
|
1.0
|
|
CG
|
B:GLU105
|
4.3
|
29.5
|
1.0
|
|
N
|
B:ASN98
|
4.3
|
27.9
|
1.0
|
|
CB
|
B:ASP94
|
4.3
|
25.8
|
1.0
|
|
CA
|
B:TYR100
|
4.3
|
24.1
|
1.0
|
|
OD1
|
B:ASP94
|
4.3
|
26.2
|
1.0
|
|
O
|
B:HOH1010
|
4.4
|
22.8
|
1.0
|
|
N
|
B:ILE101
|
4.4
|
22.8
|
1.0
|
|
C
|
B:ASP94
|
4.4
|
28.9
|
1.0
|
|
N
|
B:ASP96
|
4.4
|
32.1
|
1.0
|
|
CA
|
B:ILE101
|
4.5
|
21.1
|
1.0
|
|
CB
|
B:ASP96
|
4.5
|
32.8
|
1.0
|
|
CB
|
B:ASN98
|
4.6
|
27.3
|
1.0
|
|
N
|
B:SER102
|
4.6
|
23.7
|
1.0
|
|
N
|
B:GLY97
|
4.6
|
31.7
|
1.0
|
|
N
|
B:LYS95
|
4.7
|
32.1
|
1.0
|
|
CB
|
B:TYR100
|
4.7
|
24.8
|
1.0
|
|
O
|
B:HOH1013
|
4.8
|
36.0
|
1.0
|
|
CA
|
B:ASP96
|
4.8
|
33.3
|
1.0
|
|
CA
|
B:ASN98
|
4.8
|
27.4
|
1.0
|
|
N
|
B:GLY99
|
4.8
|
25.8
|
1.0
|
|
C
|
B:ASP96
|
4.8
|
32.2
|
1.0
|
|
O
|
B:ASP94
|
4.9
|
29.0
|
1.0
|
|
Calcium binding site 8 out
of 8 in 2r28
Go back to
Calcium Binding Sites List in 2r28
Calcium binding site 8 out
of 8 in the The Complex Structure of Calmodulin Bound to A Calcineurin Peptide
 Mono view
 Stereo pair view
|
|
A full contact list of Calcium with other atoms in the Ca binding
site number 8 of The Complex Structure of Calmodulin Bound to A Calcineurin Peptide within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca1004
b:22.0
occ:1.00
|
OD1
|
B:ASP130
|
2.3
|
24.8
|
1.0
|
|
O
|
B:GLN136
|
2.3
|
24.6
|
1.0
|
|
OD1
|
B:ASP134
|
2.3
|
22.4
|
1.0
|
|
OE2
|
B:GLU141
|
2.4
|
24.0
|
1.0
|
|
O
|
B:HOH1035
|
2.5
|
23.6
|
1.0
|
|
OE1
|
B:GLU141
|
2.6
|
23.6
|
1.0
|
|
OD1
|
B:ASP132
|
2.6
|
28.5
|
1.0
|
|
CD
|
B:GLU141
|
2.8
|
22.8
|
1.0
|
|
CG
|
B:ASP134
|
3.3
|
24.2
|
1.0
|
|
CG
|
B:ASP132
|
3.3
|
30.8
|
1.0
|
|
CG
|
B:ASP130
|
3.4
|
27.5
|
1.0
|
|
C
|
B:GLN136
|
3.5
|
23.1
|
1.0
|
|
OD2
|
B:ASP132
|
3.6
|
32.3
|
1.0
|
|
OD2
|
B:ASP134
|
3.8
|
27.4
|
1.0
|
|
N
|
B:ASP134
|
4.0
|
26.1
|
1.0
|
|
CA
|
B:ASP130
|
4.1
|
29.0
|
1.0
|
|
CB
|
B:ASP130
|
4.2
|
28.5
|
1.0
|
|
N
|
B:ASP132
|
4.3
|
29.1
|
1.0
|
|
N
|
B:GLN136
|
4.3
|
23.6
|
1.0
|
|
OD2
|
B:ASP130
|
4.3
|
24.2
|
1.0
|
|
CG
|
B:GLU141
|
4.3
|
21.0
|
1.0
|
|
N
|
B:ASN138
|
4.4
|
20.6
|
1.0
|
|
CB
|
B:ASP134
|
4.4
|
23.9
|
1.0
|
|
CA
|
B:VAL137
|
4.4
|
20.6
|
1.0
|
|
N
|
B:VAL137
|
4.4
|
23.3
|
1.0
|
|
C
|
B:ASP130
|
4.4
|
29.8
|
1.0
|
|
CA
|
B:GLN136
|
4.5
|
23.2
|
1.0
|
|
N
|
B:GLY133
|
4.5
|
28.9
|
1.0
|
|
CA
|
B:ASP134
|
4.6
|
24.0
|
1.0
|
|
CB
|
B:ASP132
|
4.6
|
29.8
|
1.0
|
|
N
|
B:GLY135
|
4.7
|
23.0
|
1.0
|
|
N
|
B:ILE131
|
4.7
|
29.9
|
1.0
|
|
CA
|
B:ASP132
|
4.7
|
30.0
|
1.0
|
|
C
|
B:ASP132
|
4.8
|
28.9
|
1.0
|
|
C
|
B:ASP134
|
4.8
|
23.8
|
1.0
|
|
C
|
B:VAL137
|
4.9
|
21.1
|
1.0
|
|
CG
|
B:ASN138
|
4.9
|
23.5
|
1.0
|
|
O
|
B:ASP130
|
4.9
|
30.3
|
1.0
|
|
ND2
|
B:ASN138
|
5.0
|
26.1
|
1.0
|
|
Reference:
Q.Ye,
H.Wang,
J.Zheng,
Q.Wei,
Z.Jia.
The Complex Structure of Calmodulin Bound to A Calcineurin Peptide. Proteins V. 73 19 2008.
ISSN: ISSN 0887-3585
PubMed: 18384083
DOI: 10.1002/PROT.22032
Page generated: Sat Dec 12 03:51:39 2020
|
