Calcium in PDB 1lbz: Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
Enzymatic activity of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
All present enzymatic activity of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate:
3.1.3.11;
3.1.3.25;
Protein crystallography data
The structure of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate, PDB code: 1lbz
was solved by
K.A.Stieglitz,
K.A.Johnson,
H.Yang,
M.F.Roberts,
B.A.Seaton,
J.F.Head,
B.Stec,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
30.00 /
2.20
|
Space group
|
P 32
|
Cell size a, b, c (Å), α, β, γ (°)
|
89.610,
89.610,
102.940,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
21.3 /
25
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
(pdb code 1lbz). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 6 binding sites of Calcium where determined in the
Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate, PDB code: 1lbz:
Jump to Calcium binding site number:
1;
2;
3;
4;
5;
6;
Calcium binding site 1 out
of 6 in 1lbz
Go back to
Calcium Binding Sites List in 1lbz
Calcium binding site 1 out
of 6 in the Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca290
b:15.8
occ:1.00
|
OD2
|
A:ASP85
|
2.3
|
11.3
|
1.0
|
OD1
|
A:ASP200
|
2.8
|
25.9
|
1.0
|
O1P
|
A:FBP295
|
2.8
|
32.5
|
1.0
|
O1
|
A:FBP295
|
2.8
|
27.1
|
1.0
|
OD2
|
A:ASP82
|
2.8
|
27.6
|
1.0
|
OE2
|
A:GLU67
|
2.9
|
86.3
|
1.0
|
OE1
|
A:GLU67
|
3.0
|
98.1
|
1.0
|
P1
|
A:FBP295
|
3.3
|
32.6
|
1.0
|
OD2
|
A:ASP200
|
3.3
|
41.5
|
1.0
|
CD
|
A:GLU67
|
3.4
|
72.4
|
1.0
|
CG
|
A:ASP200
|
3.4
|
27.8
|
1.0
|
CG
|
A:ASP85
|
3.4
|
28.0
|
1.0
|
O2P
|
A:FBP295
|
3.6
|
18.7
|
1.0
|
CA
|
A:CA291
|
3.8
|
10.0
|
1.0
|
C1
|
A:FBP295
|
3.9
|
23.6
|
1.0
|
CG
|
A:ASP82
|
4.0
|
41.5
|
1.0
|
CB
|
A:ASP85
|
4.0
|
25.9
|
1.0
|
O
|
A:HOH1124
|
4.1
|
25.4
|
1.0
|
CE1
|
A:TYR199
|
4.3
|
20.4
|
1.0
|
CD1
|
A:TYR199
|
4.5
|
26.3
|
1.0
|
OD1
|
A:ASP85
|
4.5
|
30.9
|
1.0
|
O
|
A:HOH1052
|
4.5
|
23.1
|
1.0
|
NH1
|
A:ARG197
|
4.6
|
56.8
|
1.0
|
CA
|
A:ASP85
|
4.6
|
32.6
|
1.0
|
O3P
|
A:FBP295
|
4.6
|
31.7
|
1.0
|
OD1
|
A:ASP82
|
4.6
|
46.4
|
1.0
|
C2
|
A:FBP295
|
4.8
|
34.4
|
1.0
|
C3
|
A:FBP295
|
4.8
|
32.2
|
1.0
|
CG
|
A:GLU67
|
4.9
|
63.7
|
1.0
|
CB
|
A:ASP200
|
4.9
|
12.2
|
1.0
|
O3
|
A:FBP295
|
4.9
|
20.9
|
1.0
|
|
Calcium binding site 2 out
of 6 in 1lbz
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Calcium Binding Sites List in 1lbz
Calcium binding site 2 out
of 6 in the Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca291
b:10.0
occ:1.00
|
OD1
|
A:ASP82
|
2.8
|
46.4
|
1.0
|
O1P
|
A:FBP295
|
2.8
|
32.5
|
1.0
|
O
|
A:LEU84
|
2.8
|
45.6
|
1.0
|
OE1
|
A:GLU67
|
2.8
|
98.1
|
1.0
|
O
|
A:HOH1052
|
2.8
|
23.1
|
1.0
|
OD2
|
A:ASP82
|
3.2
|
27.6
|
1.0
|
CD
|
A:GLU67
|
3.3
|
72.4
|
1.0
|
CG
|
A:ASP82
|
3.3
|
41.5
|
1.0
|
C
|
A:LEU84
|
3.4
|
40.1
|
1.0
|
OE2
|
A:GLU67
|
3.8
|
86.3
|
1.0
|
CA
|
A:CA290
|
3.8
|
15.8
|
1.0
|
N
|
A:ASP85
|
4.0
|
36.7
|
1.0
|
O
|
A:HOH1139
|
4.0
|
31.7
|
1.0
|
CA
|
A:ASP85
|
4.1
|
32.6
|
1.0
|
P1
|
A:FBP295
|
4.1
|
32.6
|
1.0
|
CG
|
A:GLU67
|
4.1
|
63.7
|
1.0
|
OG1
|
A:THR87
|
4.2
|
34.2
|
1.0
|
O2P
|
A:FBP295
|
4.2
|
18.7
|
1.0
|
O
|
A:HOH1124
|
4.2
|
25.4
|
1.0
|
N
|
A:LEU84
|
4.2
|
16.4
|
1.0
|
CB
|
A:GLU67
|
4.3
|
56.1
|
1.0
|
CA
|
A:LEU84
|
4.4
|
27.1
|
1.0
|
OD1
|
A:ASP46
|
4.5
|
33.0
|
1.0
|
CB
|
A:ASP85
|
4.6
|
25.9
|
1.0
|
CB
|
A:ASP82
|
4.7
|
28.7
|
1.0
|
OD2
|
A:ASP85
|
4.8
|
11.3
|
1.0
|
O3P
|
A:FBP295
|
4.8
|
31.7
|
1.0
|
OE1
|
A:GLU68
|
4.9
|
51.5
|
1.0
|
CB
|
A:LEU84
|
5.0
|
24.1
|
1.0
|
O1
|
A:FBP295
|
5.0
|
27.1
|
1.0
|
|
Calcium binding site 3 out
of 6 in 1lbz
Go back to
Calcium Binding Sites List in 1lbz
Calcium binding site 3 out
of 6 in the Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca292
b:10.3
occ:1.00
|
O
|
A:HOH1117
|
2.8
|
32.9
|
1.0
|
O
|
A:HOH1139
|
2.8
|
31.7
|
1.0
|
O
|
A:HOH1025
|
2.8
|
10.2
|
1.0
|
O
|
A:PRO41
|
2.8
|
40.4
|
1.0
|
OG1
|
A:THR40
|
2.8
|
68.1
|
1.0
|
O
|
A:HOH1124
|
2.8
|
25.4
|
1.0
|
O
|
A:HOH1138
|
2.8
|
61.3
|
1.0
|
CB
|
A:THR40
|
3.3
|
41.5
|
1.0
|
C
|
A:PRO41
|
3.8
|
38.4
|
1.0
|
C
|
A:THR40
|
3.8
|
38.4
|
1.0
|
N
|
A:PRO41
|
4.0
|
36.9
|
1.0
|
O
|
A:THR40
|
4.0
|
39.9
|
1.0
|
O
|
A:HOH1052
|
4.0
|
23.1
|
1.0
|
OD2
|
A:ASP46
|
4.1
|
19.4
|
1.0
|
CA
|
A:THR40
|
4.2
|
42.1
|
1.0
|
OE2
|
A:GLU68
|
4.4
|
55.1
|
1.0
|
CD
|
A:PRO41
|
4.4
|
41.3
|
1.0
|
CG2
|
A:THR40
|
4.5
|
10.3
|
1.0
|
CA
|
A:PRO41
|
4.5
|
36.0
|
1.0
|
OD2
|
A:ASP38
|
4.6
|
25.1
|
1.0
|
OE2
|
A:GLU67
|
4.6
|
86.3
|
1.0
|
OE1
|
A:GLU68
|
4.7
|
51.5
|
1.0
|
N
|
A:THR42
|
4.7
|
32.9
|
1.0
|
O2P
|
A:FBP295
|
4.8
|
18.7
|
1.0
|
OD1
|
A:ASP38
|
4.8
|
35.6
|
1.0
|
CG
|
A:GLU67
|
4.8
|
63.7
|
1.0
|
CA
|
A:THR42
|
5.0
|
22.1
|
1.0
|
|
Calcium binding site 4 out
of 6 in 1lbz
Go back to
Calcium Binding Sites List in 1lbz
Calcium binding site 4 out
of 6 in the Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca590
b:10.0
occ:1.00
|
OD2
|
B:ASP382
|
2.8
|
24.9
|
1.0
|
O1P
|
B:FBP595
|
2.8
|
12.4
|
1.0
|
OD2
|
B:ASP500
|
2.8
|
70.2
|
1.0
|
OD1
|
B:ASP385
|
2.8
|
26.4
|
1.0
|
O1
|
B:FBP595
|
2.8
|
65.3
|
1.0
|
CG
|
B:ASP500
|
3.3
|
68.4
|
1.0
|
P1
|
B:FBP595
|
3.5
|
49.4
|
1.0
|
OD1
|
B:ASP500
|
3.5
|
79.9
|
1.0
|
C1
|
B:FBP595
|
3.7
|
66.4
|
1.0
|
CA
|
B:CA591
|
3.9
|
11.0
|
1.0
|
CG
|
B:ASP385
|
3.9
|
13.3
|
1.0
|
CG
|
B:ASP382
|
4.0
|
34.4
|
1.0
|
CB
|
B:ASP385
|
4.3
|
15.2
|
1.0
|
CA
|
B:ASP385
|
4.3
|
14.4
|
1.0
|
CB
|
B:ASP500
|
4.4
|
63.8
|
1.0
|
O3P
|
B:FBP595
|
4.4
|
41.3
|
1.0
|
CA
|
B:ASP500
|
4.4
|
50.5
|
1.0
|
O3
|
B:FBP595
|
4.6
|
53.5
|
1.0
|
O2P
|
B:FBP595
|
4.6
|
77.9
|
1.0
|
OE2
|
B:GLU367
|
4.7
|
29.7
|
1.0
|
OD1
|
B:ASP382
|
4.8
|
38.3
|
1.0
|
C2
|
B:FBP595
|
4.8
|
63.2
|
1.0
|
OE1
|
B:GLU367
|
4.8
|
19.4
|
1.0
|
CB
|
B:ASP382
|
4.9
|
26.4
|
1.0
|
CD1
|
B:TYR499
|
4.9
|
27.6
|
1.0
|
CE1
|
B:TYR499
|
4.9
|
33.6
|
1.0
|
CD
|
B:GLU367
|
4.9
|
41.4
|
1.0
|
OD2
|
B:ASP385
|
5.0
|
38.3
|
1.0
|
C3
|
B:FBP595
|
5.0
|
58.3
|
1.0
|
|
Calcium binding site 5 out
of 6 in 1lbz
Go back to
Calcium Binding Sites List in 1lbz
Calcium binding site 5 out
of 6 in the Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 5 of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca591
b:11.0
occ:1.00
|
O1P
|
B:FBP595
|
2.8
|
12.4
|
1.0
|
O
|
B:LEU384
|
2.8
|
46.6
|
1.0
|
O
|
B:HOH1068
|
2.8
|
23.8
|
1.0
|
OE2
|
B:GLU367
|
2.8
|
29.7
|
1.0
|
O
|
B:HOH1064
|
2.8
|
37.6
|
1.0
|
OD1
|
B:ASP382
|
2.8
|
38.3
|
1.0
|
OD2
|
B:ASP382
|
2.8
|
24.9
|
1.0
|
CG
|
B:ASP382
|
3.3
|
34.4
|
1.0
|
C
|
B:LEU384
|
3.5
|
31.2
|
1.0
|
CD
|
B:GLU367
|
3.7
|
41.4
|
1.0
|
CA
|
B:CA590
|
3.9
|
10.0
|
1.0
|
OE1
|
B:GLU367
|
3.9
|
19.4
|
1.0
|
N
|
B:ASP385
|
4.1
|
18.6
|
1.0
|
CA
|
B:ASP385
|
4.1
|
14.4
|
1.0
|
OG1
|
B:THR387
|
4.2
|
39.9
|
1.0
|
P1
|
B:FBP595
|
4.3
|
49.4
|
1.0
|
OD1
|
B:ASP346
|
4.4
|
42.0
|
1.0
|
CA
|
B:LEU384
|
4.5
|
28.6
|
1.0
|
N
|
B:LEU384
|
4.5
|
23.1
|
1.0
|
O3P
|
B:FBP595
|
4.6
|
41.3
|
1.0
|
CB
|
B:LEU384
|
4.8
|
26.1
|
1.0
|
CB
|
B:ASP382
|
4.8
|
26.4
|
1.0
|
N
|
B:GLY386
|
4.9
|
23.6
|
1.0
|
O2P
|
B:FBP595
|
5.0
|
77.9
|
1.0
|
C
|
B:ASP385
|
5.0
|
16.0
|
1.0
|
|
Calcium binding site 6 out
of 6 in 1lbz
Go back to
Calcium Binding Sites List in 1lbz
Calcium binding site 6 out
of 6 in the Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 6 of Crystal Structure of A Complex (P32 Crystal Form) of Dual Activity Fbpase/Impase (AF2372) From Archaeoglobus Fulgidus with 3 Calcium Ions and Fructose-1,6 Bisphosphate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca592
b:13.6
occ:1.00
|
O
|
B:HOH1140
|
2.7
|
21.9
|
1.0
|
O
|
B:HOH1141
|
2.8
|
39.0
|
1.0
|
O
|
B:HOH1113
|
2.8
|
27.8
|
1.0
|
O
|
B:PRO341
|
2.8
|
39.2
|
1.0
|
OG1
|
B:THR340
|
2.8
|
14.4
|
1.0
|
OE1
|
B:GLU367
|
3.4
|
19.4
|
1.0
|
O
|
B:HOH1064
|
3.8
|
37.6
|
1.0
|
OD1
|
B:ASP338
|
4.0
|
52.9
|
1.0
|
C
|
B:PRO341
|
4.0
|
41.0
|
1.0
|
CB
|
B:THR340
|
4.1
|
25.7
|
1.0
|
CD
|
B:GLU367
|
4.2
|
41.4
|
1.0
|
O
|
B:HOH1073
|
4.2
|
32.4
|
1.0
|
OD2
|
B:ASP346
|
4.3
|
39.3
|
1.0
|
OE1
|
B:GLU368
|
4.3
|
23.7
|
1.0
|
OE2
|
B:GLU368
|
4.4
|
28.2
|
1.0
|
C
|
B:THR340
|
4.7
|
14.7
|
1.0
|
OE2
|
B:GLU367
|
4.7
|
29.7
|
1.0
|
CG
|
B:ASP346
|
4.7
|
36.2
|
1.0
|
N
|
B:PRO341
|
4.7
|
18.8
|
1.0
|
CG
|
B:ASP338
|
4.7
|
35.9
|
1.0
|
CA
|
B:THR342
|
4.8
|
32.0
|
1.0
|
CD
|
B:GLU368
|
4.8
|
20.2
|
1.0
|
OD2
|
B:ASP338
|
4.8
|
28.8
|
1.0
|
O
|
B:THR340
|
4.8
|
16.1
|
1.0
|
N
|
B:THR342
|
4.8
|
40.0
|
1.0
|
|
Reference:
K.A.Stieglitz,
K.A.Johnson,
H.Yang,
M.F.Roberts,
B.A.Seaton,
J.F.Head,
B.Stec.
Crystal Structure of A Dual Activity Impase/Fbpase (AF2372) From Archaeoglobus Fulgidus. the Story of A Mobile Loop. J.Biol.Chem. V. 277 22863 2002.
ISSN: ISSN 0021-9258
PubMed: 11940584
DOI: 10.1074/JBC.M201042200
Page generated: Thu Jul 11 11:50:23 2024
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