Calcium in PDB 1bcy: Recombinant Rat Annexin V, T72K Mutant
Protein crystallography data
The structure of Recombinant Rat Annexin V, T72K Mutant, PDB code: 1bcy
was solved by
Y.D.Mo,
M.A.Swairjo,
C.W.Li,
J.F.Head,
B.A.Seaton,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
10.00 /
1.95
|
Space group
|
H 3
|
Cell size a, b, c (Å), α, β, γ (°)
|
157.380,
157.380,
37.420,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
22.2 /
29.2
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Recombinant Rat Annexin V, T72K Mutant
(pdb code 1bcy). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 5 binding sites of Calcium where determined in the
Recombinant Rat Annexin V, T72K Mutant, PDB code: 1bcy:
Jump to Calcium binding site number:
1;
2;
3;
4;
5;
Calcium binding site 1 out
of 5 in 1bcy
Go back to
Calcium Binding Sites List in 1bcy
Calcium binding site 1 out
of 5 in the Recombinant Rat Annexin V, T72K Mutant
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Recombinant Rat Annexin V, T72K Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca401
b:8.2
occ:1.00
|
O
|
A:GLY28
|
2.7
|
44.3
|
1.0
|
OE1
|
A:GLU70
|
2.7
|
35.7
|
1.0
|
O
|
A:MET26
|
2.7
|
32.7
|
1.0
|
OE2
|
A:GLU70
|
2.8
|
35.5
|
1.0
|
O
|
A:GLY30
|
2.8
|
34.5
|
1.0
|
O
|
A:HOH634
|
2.9
|
55.4
|
1.0
|
O
|
A:HOH589
|
3.0
|
51.8
|
1.0
|
CD
|
A:GLU70
|
3.1
|
35.4
|
1.0
|
C
|
A:GLY28
|
3.7
|
45.0
|
1.0
|
C
|
A:GLY30
|
3.8
|
38.5
|
1.0
|
N
|
A:GLY30
|
3.9
|
43.4
|
1.0
|
C
|
A:MET26
|
3.9
|
34.8
|
1.0
|
C
|
A:LEU29
|
4.2
|
44.5
|
1.0
|
CA
|
A:GLY30
|
4.4
|
40.7
|
1.0
|
N
|
A:GLY28
|
4.4
|
45.9
|
1.0
|
CA
|
A:LEU29
|
4.4
|
44.8
|
1.0
|
N
|
A:LEU29
|
4.5
|
45.8
|
1.0
|
OG1
|
A:THR31
|
4.5
|
32.0
|
1.0
|
C
|
A:LYS27
|
4.6
|
44.6
|
1.0
|
CA
|
A:MET26
|
4.6
|
31.7
|
1.0
|
CG
|
A:GLU70
|
4.6
|
34.4
|
1.0
|
CA
|
A:GLY28
|
4.7
|
45.3
|
1.0
|
O
|
A:HOH557
|
4.7
|
31.1
|
1.0
|
O
|
A:HOH613
|
4.8
|
32.2
|
1.0
|
O
|
A:LEU29
|
4.8
|
46.6
|
1.0
|
N
|
A:THR31
|
4.8
|
36.0
|
1.0
|
N
|
A:LYS27
|
4.9
|
39.4
|
1.0
|
O3
|
A:SO4450
|
4.9
|
35.9
|
1.0
|
O
|
A:LYS27
|
4.9
|
47.6
|
1.0
|
|
Calcium binding site 2 out
of 5 in 1bcy
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Calcium Binding Sites List in 1bcy
Calcium binding site 2 out
of 5 in the Recombinant Rat Annexin V, T72K Mutant
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Recombinant Rat Annexin V, T72K Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca402
b:13.8
occ:1.00
|
O
|
A:LYS68
|
2.8
|
29.7
|
1.0
|
OE2
|
A:GLU76
|
2.8
|
44.4
|
1.0
|
O
|
A:LEU71
|
2.9
|
31.9
|
1.0
|
O
|
A:HOH636
|
3.0
|
57.2
|
1.0
|
O
|
A:HOH637
|
3.2
|
46.7
|
1.0
|
C
|
A:LYS68
|
4.0
|
28.2
|
1.0
|
C
|
A:LEU71
|
4.1
|
30.1
|
1.0
|
CD
|
A:GLU76
|
4.1
|
38.2
|
1.0
|
CB
|
A:LYS72
|
4.2
|
40.2
|
1.0
|
CA
|
A:LYS72
|
4.3
|
36.7
|
1.0
|
O
|
A:SER69
|
4.7
|
31.5
|
1.0
|
N
|
A:LYS72
|
4.7
|
35.6
|
1.0
|
C
|
A:SER69
|
4.8
|
30.7
|
1.0
|
CA
|
A:SER69
|
4.8
|
32.4
|
1.0
|
N
|
A:SER69
|
4.9
|
31.8
|
1.0
|
OE1
|
A:GLU76
|
4.9
|
41.1
|
1.0
|
CA
|
A:LYS68
|
4.9
|
24.9
|
1.0
|
CG
|
A:GLU76
|
5.0
|
30.2
|
1.0
|
|
Calcium binding site 3 out
of 5 in 1bcy
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Calcium Binding Sites List in 1bcy
Calcium binding site 3 out
of 5 in the Recombinant Rat Annexin V, T72K Mutant
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Recombinant Rat Annexin V, T72K Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca407
b:2.0
occ:1.00
|
O
|
A:LYS184
|
2.5
|
16.5
|
1.0
|
O
|
A:GLY181
|
2.6
|
12.4
|
1.0
|
O
|
A:GLY186
|
2.6
|
17.8
|
1.0
|
OE1
|
A:GLU226
|
2.6
|
24.6
|
1.0
|
O
|
A:HOH510
|
2.7
|
11.8
|
1.0
|
OE2
|
A:GLU226
|
2.8
|
22.3
|
1.0
|
O
|
A:HOH532
|
2.8
|
15.3
|
1.0
|
CD
|
A:GLU226
|
3.1
|
22.2
|
1.0
|
C
|
A:GLY181
|
3.6
|
12.5
|
1.0
|
C
|
A:GLY186
|
3.6
|
12.4
|
1.0
|
C
|
A:LYS184
|
3.6
|
11.5
|
1.0
|
N
|
A:GLY186
|
3.7
|
13.7
|
1.0
|
CA
|
A:GLY186
|
4.2
|
11.1
|
1.0
|
O
|
A:HOH549
|
4.2
|
33.3
|
1.0
|
O
|
A:GLU182
|
4.4
|
12.1
|
1.0
|
N
|
A:LYS184
|
4.4
|
16.4
|
1.0
|
CA
|
A:LYS184
|
4.4
|
13.8
|
1.0
|
CA
|
A:GLY181
|
4.4
|
7.7
|
1.0
|
OG1
|
A:THR187
|
4.4
|
15.7
|
1.0
|
O
|
A:HOH506
|
4.5
|
19.5
|
1.0
|
N
|
A:GLU182
|
4.5
|
12.7
|
1.0
|
CA
|
A:GLU182
|
4.6
|
11.8
|
1.0
|
C
|
A:TRP185
|
4.6
|
14.5
|
1.0
|
CG
|
A:GLU226
|
4.6
|
16.2
|
1.0
|
C
|
A:GLU182
|
4.6
|
13.6
|
1.0
|
CB
|
A:LYS184
|
4.6
|
17.0
|
1.0
|
N
|
A:TRP185
|
4.6
|
9.2
|
1.0
|
N
|
A:THR187
|
4.6
|
15.3
|
1.0
|
CA
|
A:TRP185
|
4.7
|
9.2
|
1.0
|
CA
|
A:THR187
|
4.9
|
11.5
|
1.0
|
|
Calcium binding site 4 out
of 5 in 1bcy
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Calcium Binding Sites List in 1bcy
Calcium binding site 4 out
of 5 in the Recombinant Rat Annexin V, T72K Mutant
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Recombinant Rat Annexin V, T72K Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca408
b:11.3
occ:1.00
|
OE1
|
A:GLU232
|
2.9
|
22.8
|
1.0
|
O
|
A:ASP224
|
2.9
|
23.7
|
1.0
|
O
|
A:THR227
|
3.0
|
25.0
|
1.0
|
OD1
|
A:ASP224
|
3.2
|
34.0
|
1.0
|
OE2
|
A:GLU232
|
3.3
|
30.5
|
1.0
|
CD
|
A:GLU232
|
3.3
|
20.0
|
1.0
|
C
|
A:ASP224
|
3.9
|
22.4
|
1.0
|
CG
|
A:ASP224
|
4.0
|
31.8
|
1.0
|
C
|
A:THR227
|
4.1
|
26.4
|
1.0
|
CA
|
A:SER228
|
4.2
|
31.8
|
1.0
|
CA
|
A:ASP224
|
4.2
|
19.7
|
1.0
|
CB
|
A:SER228
|
4.3
|
32.9
|
1.0
|
N
|
A:SER228
|
4.6
|
30.1
|
1.0
|
CG
|
A:GLU232
|
4.6
|
15.4
|
1.0
|
OD2
|
A:ASP224
|
4.7
|
36.1
|
1.0
|
CB
|
A:ASP224
|
4.8
|
26.6
|
1.0
|
|
Calcium binding site 5 out
of 5 in 1bcy
Go back to
Calcium Binding Sites List in 1bcy
Calcium binding site 5 out
of 5 in the Recombinant Rat Annexin V, T72K Mutant
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 5 of Recombinant Rat Annexin V, T72K Mutant within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca410
b:22.1
occ:1.00
|
OD1
|
A:ASP301
|
2.5
|
45.3
|
1.0
|
O
|
A:ALA260
|
2.7
|
58.1
|
1.0
|
O
|
A:GLY259
|
2.8
|
64.2
|
1.0
|
OD2
|
A:ASP301
|
2.8
|
46.1
|
1.0
|
CG
|
A:ASP301
|
3.0
|
43.4
|
1.0
|
O
|
A:MET257
|
3.1
|
45.9
|
1.0
|
O
|
A:GLY261
|
3.2
|
45.7
|
1.0
|
C
|
A:ALA260
|
3.6
|
56.7
|
1.0
|
C
|
A:GLY259
|
3.9
|
61.2
|
1.0
|
C
|
A:MET257
|
4.2
|
43.1
|
1.0
|
CA
|
A:ALA260
|
4.3
|
57.8
|
1.0
|
C
|
A:GLY261
|
4.3
|
47.0
|
1.0
|
CB
|
A:ASP301
|
4.4
|
40.9
|
1.0
|
N
|
A:GLY261
|
4.6
|
53.6
|
1.0
|
N
|
A:ALA260
|
4.6
|
59.2
|
1.0
|
OG1
|
A:THR262
|
4.6
|
43.7
|
1.0
|
O
|
A:LYS258
|
4.7
|
56.0
|
1.0
|
CA
|
A:GLY261
|
4.8
|
48.4
|
1.0
|
C
|
A:LYS258
|
4.8
|
55.5
|
1.0
|
CA
|
A:ASP301
|
4.9
|
41.0
|
1.0
|
CA
|
A:MET257
|
5.0
|
39.1
|
1.0
|
N
|
A:GLY259
|
5.0
|
57.6
|
1.0
|
|
Reference:
B.Campos,
Y.D.Mo,
T.R.Mealy,
C.W.Li,
M.A.Swairjo,
C.Balch,
J.F.Head,
G.Retzinger,
J.R.Dedman,
B.A.Seaton.
Mutational and Crystallographic Analyses of Interfacial Residues in Annexin V Suggest Direct Interactions with Phospholipid Membrane Components. Biochemistry V. 37 8004 1998.
ISSN: ISSN 0006-2960
PubMed: 9609693
DOI: 10.1021/BI973142N
Page generated: Thu Jul 11 06:21:58 2024
|