Manganese in PDB 1do8: Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme
Enzymatic activity of Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme
All present enzymatic activity of Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme:
1.1.1.39;
Protein crystallography data
The structure of Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme, PDB code: 1do8
was solved by
Z.Yang,
D.L.Floyd,
G.Loeber,
L.Tong,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
20.00 /
2.20
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
229.000,
118.700,
113.000,
90.00,
109.60,
90.00
|
R / Rfree (%)
|
20.4 /
26.3
|
Manganese Binding Sites:
The binding sites of Manganese atom in the Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme
(pdb code 1do8). This binding sites where shown within
5.0 Angstroms radius around Manganese atom.
In total 4 binding sites of Manganese where determined in the
Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme, PDB code: 1do8:
Jump to Manganese binding site number:
1;
2;
3;
4;
Manganese binding site 1 out
of 4 in 1do8
Go back to
Manganese Binding Sites List in 1do8
Manganese binding site 1 out
of 4 in the Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 1 of Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mn604
b:18.3
occ:1.00
|
OD1
|
A:ASP256
|
2.2
|
18.6
|
1.0
|
OD1
|
A:ASP279
|
2.2
|
9.8
|
1.0
|
O4
|
A:OXL603
|
2.3
|
16.7
|
1.0
|
O
|
A:HOH606
|
2.4
|
13.8
|
1.0
|
OE1
|
A:GLU255
|
2.4
|
17.3
|
1.0
|
O1
|
A:OXL603
|
2.4
|
16.1
|
1.0
|
C2
|
A:OXL603
|
3.0
|
19.1
|
1.0
|
C1
|
A:OXL603
|
3.1
|
20.5
|
1.0
|
CG
|
A:ASP279
|
3.2
|
15.1
|
1.0
|
CG
|
A:ASP256
|
3.3
|
18.7
|
1.0
|
OD2
|
A:ASP279
|
3.4
|
14.0
|
1.0
|
CD
|
A:GLU255
|
3.5
|
17.5
|
1.0
|
NH2
|
A:ARG165
|
3.7
|
24.0
|
1.0
|
OD2
|
A:ASP256
|
3.7
|
16.9
|
1.0
|
CG
|
A:GLU255
|
3.9
|
13.4
|
1.0
|
O2
|
A:OXL603
|
4.2
|
19.3
|
1.0
|
N
|
A:ASP256
|
4.2
|
16.2
|
1.0
|
O3
|
A:OXL603
|
4.3
|
16.8
|
1.0
|
NZ
|
A:LYS183
|
4.4
|
19.9
|
1.0
|
CZ
|
A:ARG165
|
4.5
|
22.9
|
1.0
|
NH1
|
A:ARG165
|
4.5
|
17.6
|
1.0
|
O
|
A:HOH4750
|
4.5
|
50.9
|
1.0
|
CB
|
A:ASP256
|
4.5
|
16.2
|
1.0
|
CB
|
A:ASP279
|
4.5
|
15.3
|
1.0
|
C5N
|
A:NAD601
|
4.6
|
15.8
|
1.0
|
CE
|
A:LYS183
|
4.6
|
18.1
|
1.0
|
OE2
|
A:GLU255
|
4.6
|
21.8
|
1.0
|
ND2
|
A:ASN467
|
4.6
|
15.1
|
1.0
|
CA
|
A:ASP256
|
4.7
|
16.8
|
1.0
|
CD2
|
A:LEU167
|
4.8
|
19.4
|
1.0
|
|
Manganese binding site 2 out
of 4 in 1do8
Go back to
Manganese Binding Sites List in 1do8
Manganese binding site 2 out
of 4 in the Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 2 of Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mn1604
b:19.5
occ:1.00
|
OD1
|
B:ASP1256
|
2.2
|
13.4
|
1.0
|
OE1
|
B:GLU1255
|
2.3
|
15.0
|
1.0
|
OD1
|
B:ASP1279
|
2.3
|
21.7
|
1.0
|
O1
|
B:OXL1603
|
2.4
|
21.2
|
1.0
|
O
|
B:HOH1606
|
2.4
|
15.7
|
1.0
|
O4
|
B:OXL1603
|
2.6
|
20.8
|
1.0
|
C1
|
B:OXL1603
|
3.1
|
20.7
|
1.0
|
C2
|
B:OXL1603
|
3.2
|
20.3
|
1.0
|
CD
|
B:GLU1255
|
3.2
|
16.9
|
1.0
|
CG
|
B:ASP1279
|
3.2
|
20.8
|
1.0
|
CG
|
B:ASP1256
|
3.4
|
17.4
|
1.0
|
CG
|
B:GLU1255
|
3.5
|
15.8
|
1.0
|
OD2
|
B:ASP1279
|
3.5
|
21.6
|
1.0
|
NH2
|
B:ARG1165
|
3.6
|
18.7
|
1.0
|
OD2
|
B:ASP1256
|
4.0
|
17.7
|
1.0
|
N
|
B:ASP1256
|
4.2
|
16.3
|
1.0
|
NZ
|
B:LYS1183
|
4.2
|
8.3
|
1.0
|
O3
|
B:OXL1603
|
4.2
|
15.3
|
1.0
|
O2
|
B:OXL1603
|
4.3
|
25.4
|
1.0
|
CE
|
B:LYS1183
|
4.4
|
6.9
|
1.0
|
OE2
|
B:GLU1255
|
4.4
|
19.7
|
1.0
|
CZ
|
B:ARG1165
|
4.5
|
13.7
|
1.0
|
CB
|
B:ASP1256
|
4.5
|
18.2
|
1.0
|
NH1
|
B:ARG1165
|
4.6
|
12.6
|
1.0
|
CB
|
B:ASP1279
|
4.6
|
18.5
|
1.0
|
CA
|
B:ASP1256
|
4.6
|
17.9
|
1.0
|
C5N
|
B:NAD1601
|
4.8
|
16.4
|
1.0
|
ND2
|
B:ASN1467
|
4.8
|
14.6
|
1.0
|
CB
|
B:GLU1255
|
4.8
|
15.2
|
1.0
|
O
|
B:HOH4687
|
4.8
|
43.9
|
1.0
|
OD2
|
B:ASP1278
|
4.9
|
14.5
|
1.0
|
C
|
B:GLU1255
|
5.0
|
16.2
|
1.0
|
|
Manganese binding site 3 out
of 4 in 1do8
Go back to
Manganese Binding Sites List in 1do8
Manganese binding site 3 out
of 4 in the Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 3 of Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mn2604
b:17.6
occ:1.00
|
OD1
|
C:ASP2279
|
2.2
|
18.4
|
1.0
|
O1
|
C:OXL2603
|
2.2
|
20.1
|
1.0
|
OD1
|
C:ASP2256
|
2.2
|
21.3
|
1.0
|
OE1
|
C:GLU2255
|
2.3
|
11.4
|
1.0
|
O4
|
C:OXL2603
|
2.4
|
21.5
|
1.0
|
O
|
C:HOH2606
|
2.6
|
16.1
|
1.0
|
C1
|
C:OXL2603
|
2.9
|
22.5
|
1.0
|
C2
|
C:OXL2603
|
3.0
|
20.7
|
1.0
|
CG
|
C:ASP2279
|
3.2
|
20.1
|
1.0
|
CG
|
C:ASP2256
|
3.2
|
22.6
|
1.0
|
CD
|
C:GLU2255
|
3.4
|
19.6
|
1.0
|
OD2
|
C:ASP2279
|
3.6
|
16.0
|
1.0
|
OD2
|
C:ASP2256
|
3.6
|
15.8
|
1.0
|
NH2
|
C:ARG2165
|
3.7
|
13.6
|
1.0
|
CG
|
C:GLU2255
|
3.8
|
15.3
|
1.0
|
NZ
|
C:LYS2183
|
3.9
|
6.6
|
1.0
|
O3
|
C:OXL2603
|
4.1
|
15.8
|
1.0
|
O2
|
C:OXL2603
|
4.2
|
24.5
|
1.0
|
N
|
C:ASP2256
|
4.3
|
19.0
|
1.0
|
OE2
|
C:GLU2255
|
4.5
|
14.3
|
1.0
|
CB
|
C:ASP2256
|
4.5
|
19.8
|
1.0
|
CB
|
C:ASP2279
|
4.5
|
16.5
|
1.0
|
C5N
|
C:NAD2601
|
4.5
|
14.6
|
1.0
|
CZ
|
C:ARG2165
|
4.6
|
14.8
|
1.0
|
NH1
|
C:ARG2165
|
4.6
|
10.7
|
1.0
|
ND2
|
C:ASN2467
|
4.7
|
11.1
|
1.0
|
CA
|
C:ASP2256
|
4.7
|
19.1
|
1.0
|
CA
|
C:ASP2279
|
5.0
|
15.3
|
1.0
|
OD2
|
C:ASP2278
|
5.0
|
14.3
|
1.0
|
|
Manganese binding site 4 out
of 4 in 1do8
Go back to
Manganese Binding Sites List in 1do8
Manganese binding site 4 out
of 4 in the Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme
Mono view
Stereo pair view
|
A full contact list of Manganese with other atoms in the Mn binding
site number 4 of Crystal Structure of A Closed Form of Human Mitochondrial Nad(P)+- Dependent Malic Enzyme within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mn3604
b:18.6
occ:1.00
|
OD1
|
D:ASP3279
|
2.2
|
7.6
|
1.0
|
OD1
|
D:ASP3256
|
2.3
|
18.5
|
1.0
|
OE1
|
D:GLU3255
|
2.3
|
16.9
|
1.0
|
O1
|
D:OXL3603
|
2.3
|
18.0
|
1.0
|
O4
|
D:OXL3603
|
2.4
|
17.5
|
1.0
|
O
|
D:HOH3606
|
2.4
|
16.4
|
1.0
|
C1
|
D:OXL3603
|
3.0
|
20.1
|
1.0
|
C2
|
D:OXL3603
|
3.0
|
18.8
|
1.0
|
CG
|
D:ASP3256
|
3.2
|
15.3
|
1.0
|
CG
|
D:ASP3279
|
3.3
|
16.6
|
1.0
|
CD
|
D:GLU3255
|
3.3
|
20.2
|
1.0
|
NH2
|
D:ARG3165
|
3.6
|
22.2
|
1.0
|
OD2
|
D:ASP3256
|
3.6
|
15.1
|
1.0
|
OD2
|
D:ASP3279
|
3.7
|
16.9
|
1.0
|
CG
|
D:GLU3255
|
3.7
|
17.8
|
1.0
|
N
|
D:ASP3256
|
4.2
|
17.3
|
1.0
|
O3
|
D:OXL3603
|
4.2
|
13.3
|
1.0
|
O2
|
D:OXL3603
|
4.2
|
22.7
|
1.0
|
NZ
|
D:LYS3183
|
4.3
|
14.6
|
1.0
|
OE2
|
D:GLU3255
|
4.4
|
25.1
|
1.0
|
CZ
|
D:ARG3165
|
4.4
|
20.1
|
1.0
|
NH1
|
D:ARG3165
|
4.4
|
13.9
|
1.0
|
CB
|
D:ASP3256
|
4.4
|
13.8
|
1.0
|
C5N
|
D:NAD3601
|
4.5
|
15.7
|
1.0
|
CB
|
D:ASP3279
|
4.6
|
16.4
|
1.0
|
CA
|
D:ASP3256
|
4.6
|
16.1
|
1.0
|
CE
|
D:LYS3183
|
4.7
|
20.2
|
1.0
|
ND2
|
D:ASN3467
|
4.7
|
18.0
|
1.0
|
O
|
D:HOH4349
|
4.8
|
20.2
|
1.0
|
CD2
|
D:LEU3167
|
5.0
|
8.9
|
1.0
|
CB
|
D:GLU3255
|
5.0
|
17.9
|
1.0
|
|
Reference:
Z.Yang,
D.L.Floyd,
G.Loeber,
L.Tong.
Structure of A Closed Form of Human Malic Enzyme and Implications For Catalytic Mechanism. Nat.Struct.Biol. V. 7 251 2000.
ISSN: ISSN 1072-8368
PubMed: 10700286
DOI: 10.1038/73378
Page generated: Sat Oct 5 10:07:12 2024
|