Magnesium in PDB 1cjb: Malarial Purine Phosphoribosyltransferase
Enzymatic activity of Malarial Purine Phosphoribosyltransferase
All present enzymatic activity of Malarial Purine Phosphoribosyltransferase:
2.4.2.8;
Protein crystallography data
The structure of Malarial Purine Phosphoribosyltransferase, PDB code: 1cjb
was solved by
W.Shi,
C.M.Li,
P.C.Tyler,
R.H.Furneaux,
S.M.Cahill,
M.E.Girvin,
C.Grubmeyer,
V.L.Schramm,
S.C.Almo,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
|
Resolution Low / High (Å)
|
20.00 /
2.00
|
|
Space group
|
C 2 2 21
|
|
Cell size a, b, c (Å), α, β, γ (°)
|
105.490,
110.390,
173.700,
90.00,
90.00,
90.00
|
|
R / Rfree (%)
|
19.6 /
23.9
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Malarial Purine Phosphoribosyltransferase
(pdb code 1cjb). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 8 binding sites of Magnesium where determined in the
Malarial Purine Phosphoribosyltransferase, PDB code: 1cjb:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Magnesium binding site 1 out
of 8 in 1cjb
Go back to
Magnesium Binding Sites List in 1cjb
Magnesium binding site 1 out
of 8 in the Malarial Purine Phosphoribosyltransferase
 Mono view
 Stereo pair view
|
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Malarial Purine Phosphoribosyltransferase within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg405
b:26.4
occ:1.00
|
O
|
A:HOH516
|
2.0
|
21.1
|
1.0
|
|
O2
|
A:POP400
|
2.1
|
22.9
|
1.0
|
|
O3'
|
A:IRP300
|
2.2
|
22.9
|
1.0
|
|
O2'
|
A:IRP300
|
2.3
|
23.9
|
1.0
|
|
O
|
A:HOH603
|
2.3
|
25.3
|
1.0
|
|
O5
|
A:POP400
|
2.4
|
25.5
|
1.0
|
|
C3'
|
A:IRP300
|
3.1
|
23.7
|
1.0
|
|
C2'
|
A:IRP300
|
3.2
|
24.9
|
1.0
|
|
O
|
A:POP400
|
3.3
|
24.2
|
1.0
|
|
P2
|
A:POP400
|
3.3
|
24.0
|
1.0
|
|
P1
|
A:POP400
|
3.3
|
23.4
|
1.0
|
|
O4
|
A:POP400
|
3.9
|
24.5
|
1.0
|
|
C4'
|
A:IRP300
|
3.9
|
23.1
|
1.0
|
|
C1'
|
A:IRP300
|
3.9
|
23.2
|
1.0
|
|
OD2
|
A:ASP145
|
4.0
|
25.4
|
1.0
|
|
O
|
A:VAL113
|
4.1
|
32.8
|
1.0
|
|
OD1
|
A:ASP145
|
4.1
|
23.9
|
1.0
|
|
O
|
A:HOH543
|
4.2
|
18.6
|
1.0
|
|
N4'
|
A:IRP300
|
4.2
|
23.6
|
1.0
|
|
N
|
A:GLY78
|
4.3
|
26.0
|
1.0
|
|
OE1
|
A:GLU144
|
4.3
|
35.3
|
1.0
|
|
O3
|
A:POP400
|
4.3
|
23.6
|
1.0
|
|
O
|
A:LEU76
|
4.3
|
27.3
|
1.0
|
|
OE2
|
A:GLU144
|
4.4
|
34.5
|
1.0
|
|
O1
|
A:POP400
|
4.4
|
26.2
|
1.0
|
|
O
|
A:HOH616
|
4.4
|
22.4
|
1.0
|
|
CG
|
A:ASP145
|
4.5
|
26.1
|
1.0
|
|
CA
|
A:GLY78
|
4.6
|
24.1
|
1.0
|
|
N
|
A:LYS77
|
4.6
|
26.3
|
1.0
|
|
O
|
A:LEU75
|
4.6
|
27.4
|
1.0
|
|
O6
|
A:POP400
|
4.7
|
22.6
|
1.0
|
|
CD
|
A:GLU144
|
4.7
|
34.6
|
1.0
|
|
C
|
A:LEU76
|
4.7
|
27.4
|
1.0
|
|
Magnesium binding site 2 out
of 8 in 1cjb
Go back to
Magnesium Binding Sites List in 1cjb
Magnesium binding site 2 out
of 8 in the Malarial Purine Phosphoribosyltransferase
 Mono view
 Stereo pair view
|
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Malarial Purine Phosphoribosyltransferase within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg406
b:27.8
occ:1.00
|
OD1
|
A:ASP204
|
2.1
|
19.6
|
1.0
|
|
O
|
A:HOH616
|
2.1
|
22.4
|
1.0
|
|
O
|
A:HOH664
|
2.2
|
29.0
|
1.0
|
|
O3
|
A:POP400
|
2.2
|
23.6
|
1.0
|
|
O4
|
A:POP400
|
2.2
|
24.5
|
1.0
|
|
O
|
A:HOH542
|
2.3
|
29.7
|
1.0
|
|
CG
|
A:ASP204
|
3.1
|
21.0
|
1.0
|
|
P1
|
A:POP400
|
3.3
|
23.4
|
1.0
|
|
P2
|
A:POP400
|
3.4
|
24.0
|
1.0
|
|
O
|
A:POP400
|
3.5
|
24.2
|
1.0
|
|
OD2
|
A:ASP204
|
3.5
|
24.5
|
1.0
|
|
O2
|
A:POP400
|
4.0
|
22.9
|
1.0
|
|
N3
|
A:IRP300
|
4.1
|
18.5
|
1.0
|
|
O
|
A:ASP204
|
4.1
|
23.0
|
1.0
|
|
NH2
|
A:ARG210
|
4.2
|
18.9
|
1.0
|
|
O2'
|
A:IRP300
|
4.3
|
23.9
|
1.0
|
|
O6
|
A:POP400
|
4.4
|
22.6
|
1.0
|
|
C1'
|
A:IRP300
|
4.4
|
23.2
|
1.0
|
|
O
|
A:HOH550
|
4.4
|
27.9
|
1.0
|
|
O5
|
A:POP400
|
4.4
|
25.5
|
1.0
|
|
NH1
|
A:ARG210
|
4.4
|
16.0
|
1.0
|
|
CB
|
A:ASP204
|
4.4
|
20.3
|
1.0
|
|
N
|
A:ASP204
|
4.5
|
18.7
|
1.0
|
|
O1
|
A:POP400
|
4.5
|
26.2
|
1.0
|
|
C
|
A:ASP204
|
4.6
|
25.2
|
1.0
|
|
CZ
|
A:ARG210
|
4.7
|
19.7
|
1.0
|
|
CB
|
A:TYR116
|
4.7
|
27.5
|
1.0
|
|
CA
|
A:ASP204
|
4.7
|
21.8
|
1.0
|
|
C4
|
A:IRP300
|
4.9
|
19.5
|
1.0
|
|
C2
|
A:IRP300
|
4.9
|
19.8
|
1.0
|
|
O
|
A:HOH613
|
4.9
|
21.5
|
1.0
|
|
C9
|
A:IRP300
|
5.0
|
23.6
|
1.0
|
|
C2'
|
A:IRP300
|
5.0
|
24.9
|
1.0
|
|
Magnesium binding site 3 out
of 8 in 1cjb
Go back to
Magnesium Binding Sites List in 1cjb
Magnesium binding site 3 out
of 8 in the Malarial Purine Phosphoribosyltransferase
 Mono view
 Stereo pair view
|
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Malarial Purine Phosphoribosyltransferase within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg405
b:26.3
occ:1.00
|
O2
|
B:POP400
|
2.1
|
25.1
|
1.0
|
|
O
|
B:HOH547
|
2.2
|
19.6
|
1.0
|
|
O3'
|
B:IRP300
|
2.2
|
27.5
|
1.0
|
|
O
|
B:HOH557
|
2.2
|
24.0
|
1.0
|
|
O6
|
B:POP400
|
2.3
|
24.3
|
1.0
|
|
O2'
|
B:IRP300
|
2.3
|
23.2
|
1.0
|
|
O
|
B:POP400
|
3.1
|
22.5
|
1.0
|
|
C3'
|
B:IRP300
|
3.2
|
24.2
|
1.0
|
|
C2'
|
B:IRP300
|
3.2
|
22.1
|
1.0
|
|
P1
|
B:POP400
|
3.2
|
23.8
|
1.0
|
|
P2
|
B:POP400
|
3.3
|
22.7
|
1.0
|
|
O5
|
B:POP400
|
3.9
|
23.9
|
1.0
|
|
C1'
|
B:IRP300
|
3.9
|
18.7
|
1.0
|
|
OD2
|
B:ASP145
|
4.0
|
22.8
|
1.0
|
|
O
|
B:HOH723
|
4.0
|
25.2
|
1.0
|
|
C4'
|
B:IRP300
|
4.0
|
22.2
|
1.0
|
|
OD1
|
B:ASP145
|
4.2
|
22.0
|
1.0
|
|
O3
|
B:POP400
|
4.2
|
28.7
|
1.0
|
|
O
|
B:LEU76
|
4.2
|
25.5
|
1.0
|
|
O1
|
B:POP400
|
4.2
|
23.4
|
1.0
|
|
N4'
|
B:IRP300
|
4.2
|
25.6
|
1.0
|
|
OE1
|
B:GLU144
|
4.3
|
29.7
|
1.0
|
|
OE2
|
B:GLU144
|
4.3
|
25.2
|
1.0
|
|
O
|
B:VAL113
|
4.3
|
25.6
|
1.0
|
|
N
|
B:GLY78
|
4.4
|
24.9
|
1.0
|
|
O
|
B:HOH548
|
4.4
|
20.5
|
1.0
|
|
CG
|
B:ASP145
|
4.5
|
25.0
|
1.0
|
|
O4
|
B:POP400
|
4.5
|
24.3
|
1.0
|
|
O
|
B:LEU75
|
4.6
|
25.5
|
1.0
|
|
N
|
B:LYS77
|
4.6
|
25.6
|
1.0
|
|
C
|
B:LEU76
|
4.7
|
25.1
|
1.0
|
|
CD
|
B:GLU144
|
4.7
|
24.4
|
1.0
|
|
CA
|
B:GLY78
|
4.7
|
27.0
|
1.0
|
|
MG
|
B:MG406
|
4.9
|
27.7
|
1.0
|
|
Magnesium binding site 4 out
of 8 in 1cjb
Go back to
Magnesium Binding Sites List in 1cjb
Magnesium binding site 4 out
of 8 in the Malarial Purine Phosphoribosyltransferase
 Mono view
 Stereo pair view
|
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Malarial Purine Phosphoribosyltransferase within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg406
b:27.7
occ:1.00
|
O
|
B:HOH552
|
2.0
|
23.6
|
1.0
|
|
OD1
|
B:ASP204
|
2.1
|
23.1
|
1.0
|
|
O
|
B:HOH548
|
2.2
|
20.5
|
1.0
|
|
O3
|
B:POP400
|
2.2
|
28.7
|
1.0
|
|
O5
|
B:POP400
|
2.2
|
23.9
|
1.0
|
|
O
|
B:HOH507
|
2.3
|
19.7
|
1.0
|
|
CG
|
B:ASP204
|
3.2
|
24.8
|
1.0
|
|
P1
|
B:POP400
|
3.3
|
23.8
|
1.0
|
|
P2
|
B:POP400
|
3.4
|
22.7
|
1.0
|
|
O
|
B:POP400
|
3.6
|
22.5
|
1.0
|
|
OD2
|
B:ASP204
|
3.6
|
24.2
|
1.0
|
|
O2
|
B:POP400
|
3.9
|
25.1
|
1.0
|
|
N3
|
B:IRP300
|
3.9
|
17.4
|
1.0
|
|
NH2
|
B:ARG210
|
4.1
|
15.9
|
1.0
|
|
O
|
B:ASP204
|
4.2
|
23.2
|
1.0
|
|
NH1
|
B:ARG210
|
4.2
|
16.4
|
1.0
|
|
C1'
|
B:IRP300
|
4.2
|
18.7
|
1.0
|
|
O2'
|
B:IRP300
|
4.3
|
23.2
|
1.0
|
|
O
|
B:HOH500
|
4.3
|
18.2
|
1.0
|
|
N
|
B:ASP204
|
4.4
|
23.1
|
1.0
|
|
O6
|
B:POP400
|
4.4
|
24.3
|
1.0
|
|
O4
|
B:POP400
|
4.4
|
24.3
|
1.0
|
|
CB
|
B:ASP204
|
4.5
|
17.9
|
1.0
|
|
O1
|
B:POP400
|
4.6
|
23.4
|
1.0
|
|
C
|
B:ASP204
|
4.6
|
24.2
|
1.0
|
|
CZ
|
B:ARG210
|
4.6
|
17.3
|
1.0
|
|
C4
|
B:IRP300
|
4.7
|
18.1
|
1.0
|
|
C2
|
B:IRP300
|
4.7
|
23.3
|
1.0
|
|
CA
|
B:ASP204
|
4.7
|
22.1
|
1.0
|
|
C9
|
B:IRP300
|
4.8
|
19.7
|
1.0
|
|
MG
|
B:MG405
|
4.9
|
26.3
|
1.0
|
|
CB
|
B:TYR116
|
4.9
|
20.1
|
1.0
|
|
C2'
|
B:IRP300
|
4.9
|
22.1
|
1.0
|
|
Magnesium binding site 5 out
of 8 in 1cjb
Go back to
Magnesium Binding Sites List in 1cjb
Magnesium binding site 5 out
of 8 in the Malarial Purine Phosphoribosyltransferase
 Mono view
 Stereo pair view
|
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Malarial Purine Phosphoribosyltransferase within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg405
b:26.9
occ:1.00
|
O2
|
C:POP400
|
2.1
|
22.2
|
1.0
|
|
O3'
|
C:IRP300
|
2.2
|
18.2
|
1.0
|
|
O
|
C:HOH641
|
2.2
|
20.5
|
1.0
|
|
O
|
C:HOH651
|
2.2
|
20.3
|
1.0
|
|
O5
|
C:POP400
|
2.3
|
27.8
|
1.0
|
|
O2'
|
C:IRP300
|
2.3
|
22.5
|
1.0
|
|
C3'
|
C:IRP300
|
3.2
|
24.5
|
1.0
|
|
C2'
|
C:IRP300
|
3.3
|
21.5
|
1.0
|
|
P2
|
C:POP400
|
3.3
|
24.0
|
1.0
|
|
P1
|
C:POP400
|
3.4
|
23.9
|
1.0
|
|
O
|
C:POP400
|
3.4
|
24.7
|
1.0
|
|
O4
|
C:POP400
|
4.0
|
24.2
|
1.0
|
|
OD1
|
C:ASP145
|
4.0
|
30.8
|
1.0
|
|
C1'
|
C:IRP300
|
4.1
|
22.4
|
1.0
|
|
C4'
|
C:IRP300
|
4.1
|
23.8
|
1.0
|
|
OD2
|
C:ASP145
|
4.1
|
32.8
|
1.0
|
|
OE1
|
C:GLU144
|
4.1
|
32.0
|
1.0
|
|
O
|
C:LEU76
|
4.2
|
25.4
|
1.0
|
|
N
|
C:GLY78
|
4.2
|
21.6
|
1.0
|
|
O
|
C:HOH534
|
4.2
|
24.6
|
1.0
|
|
OE2
|
C:GLU144
|
4.2
|
32.2
|
1.0
|
|
O1
|
C:POP400
|
4.3
|
23.3
|
1.0
|
|
O
|
C:VAL113
|
4.3
|
30.1
|
1.0
|
|
O
|
C:HOH535
|
4.3
|
34.9
|
1.0
|
|
O3
|
C:POP400
|
4.4
|
23.1
|
1.0
|
|
N4'
|
C:IRP300
|
4.4
|
27.6
|
1.0
|
|
CA
|
C:GLY78
|
4.5
|
20.2
|
1.0
|
|
CG
|
C:ASP145
|
4.5
|
31.5
|
1.0
|
|
O
|
C:LEU75
|
4.5
|
27.8
|
1.0
|
|
N
|
C:LYS77
|
4.5
|
22.8
|
1.0
|
|
CD
|
C:GLU144
|
4.6
|
30.8
|
1.0
|
|
C
|
C:LEU76
|
4.6
|
23.6
|
1.0
|
|
O6
|
C:POP400
|
4.6
|
24.4
|
1.0
|
|
MG
|
C:MG406
|
5.0
|
23.7
|
1.0
|
|
Magnesium binding site 6 out
of 8 in 1cjb
Go back to
Magnesium Binding Sites List in 1cjb
Magnesium binding site 6 out
of 8 in the Malarial Purine Phosphoribosyltransferase
 Mono view
 Stereo pair view
|
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of Malarial Purine Phosphoribosyltransferase within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg406
b:23.7
occ:1.00
|
O
|
C:HOH585
|
2.0
|
22.2
|
1.0
|
|
O4
|
C:POP400
|
2.1
|
24.2
|
1.0
|
|
OD1
|
C:ASP204
|
2.2
|
29.3
|
1.0
|
|
O3
|
C:POP400
|
2.2
|
23.1
|
1.0
|
|
O
|
C:HOH554
|
2.3
|
24.5
|
1.0
|
|
O
|
C:HOH535
|
2.3
|
34.9
|
1.0
|
|
P1
|
C:POP400
|
3.2
|
23.9
|
1.0
|
|
CG
|
C:ASP204
|
3.2
|
26.7
|
1.0
|
|
P2
|
C:POP400
|
3.2
|
24.0
|
1.0
|
|
O
|
C:POP400
|
3.2
|
24.7
|
1.0
|
|
OD2
|
C:ASP204
|
3.5
|
23.1
|
1.0
|
|
O2
|
C:POP400
|
3.8
|
22.2
|
1.0
|
|
NH2
|
C:ARG210
|
4.1
|
22.3
|
1.0
|
|
N3
|
C:IRP300
|
4.2
|
20.3
|
1.0
|
|
O5
|
C:POP400
|
4.2
|
27.8
|
1.0
|
|
O2'
|
C:IRP300
|
4.3
|
22.5
|
1.0
|
|
NH1
|
C:ARG210
|
4.3
|
17.2
|
1.0
|
|
O6
|
C:POP400
|
4.3
|
24.4
|
1.0
|
|
O
|
C:ASP204
|
4.3
|
26.7
|
1.0
|
|
O
|
C:HOH576
|
4.3
|
26.1
|
1.0
|
|
O
|
C:HOH531
|
4.4
|
29.3
|
1.0
|
|
C1'
|
C:IRP300
|
4.4
|
22.4
|
1.0
|
|
O1
|
C:POP400
|
4.4
|
23.3
|
1.0
|
|
N
|
C:ASP204
|
4.5
|
23.0
|
1.0
|
|
CB
|
C:ASP204
|
4.5
|
21.3
|
1.0
|
|
CZ
|
C:ARG210
|
4.6
|
23.4
|
1.0
|
|
C
|
C:ASP204
|
4.7
|
22.2
|
1.0
|
|
CB
|
C:TYR116
|
4.8
|
24.3
|
1.0
|
|
CA
|
C:ASP204
|
4.8
|
22.9
|
1.0
|
|
O
|
C:HOH867
|
4.8
|
43.5
|
1.0
|
|
C4
|
C:IRP300
|
4.9
|
22.0
|
1.0
|
|
C2
|
C:IRP300
|
5.0
|
22.4
|
1.0
|
|
MG
|
C:MG405
|
5.0
|
26.9
|
1.0
|
|
Magnesium binding site 7 out
of 8 in 1cjb
Go back to
Magnesium Binding Sites List in 1cjb
Magnesium binding site 7 out
of 8 in the Malarial Purine Phosphoribosyltransferase
 Mono view
 Stereo pair view
|
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 7 of Malarial Purine Phosphoribosyltransferase within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg405
b:29.2
occ:1.00
|
O2
|
D:POP400
|
2.1
|
30.0
|
1.0
|
|
O
|
D:HOH685
|
2.1
|
21.8
|
1.0
|
|
O3'
|
D:IRP300
|
2.2
|
22.1
|
1.0
|
|
O
|
D:HOH562
|
2.2
|
28.9
|
1.0
|
|
O2'
|
D:IRP300
|
2.3
|
24.5
|
1.0
|
|
O5
|
D:POP400
|
2.4
|
26.5
|
1.0
|
|
C3'
|
D:IRP300
|
3.2
|
25.0
|
1.0
|
|
C2'
|
D:IRP300
|
3.2
|
24.4
|
1.0
|
|
O
|
D:POP400
|
3.3
|
29.5
|
1.0
|
|
P2
|
D:POP400
|
3.3
|
28.2
|
1.0
|
|
P1
|
D:POP400
|
3.3
|
29.2
|
1.0
|
|
O4
|
D:POP400
|
3.9
|
26.9
|
1.0
|
|
C1'
|
D:IRP300
|
4.0
|
26.2
|
1.0
|
|
OD2
|
D:ASP145
|
4.0
|
27.6
|
1.0
|
|
C4'
|
D:IRP300
|
4.1
|
24.8
|
1.0
|
|
OD1
|
D:ASP145
|
4.1
|
27.7
|
1.0
|
|
OE2
|
D:GLU144
|
4.2
|
27.3
|
1.0
|
|
O3
|
D:POP400
|
4.2
|
24.9
|
1.0
|
|
O
|
D:HOH517
|
4.2
|
24.8
|
1.0
|
|
O
|
D:VAL113
|
4.3
|
35.0
|
1.0
|
|
OE1
|
D:GLU144
|
4.3
|
27.9
|
1.0
|
|
N
|
D:GLY78
|
4.3
|
25.3
|
1.0
|
|
O1
|
D:POP400
|
4.3
|
29.8
|
1.0
|
|
O
|
D:LEU76
|
4.3
|
27.8
|
1.0
|
|
N4'
|
D:IRP300
|
4.3
|
27.4
|
1.0
|
|
O
|
D:HOH638
|
4.4
|
23.4
|
1.0
|
|
CG
|
D:ASP145
|
4.5
|
25.7
|
1.0
|
|
CD
|
D:GLU144
|
4.6
|
28.7
|
1.0
|
|
CA
|
D:GLY78
|
4.6
|
21.1
|
1.0
|
|
N
|
D:LYS77
|
4.6
|
26.6
|
1.0
|
|
O
|
D:LEU75
|
4.7
|
23.4
|
1.0
|
|
O6
|
D:POP400
|
4.7
|
22.9
|
1.0
|
|
C
|
D:LEU76
|
4.8
|
27.9
|
1.0
|
|
MG
|
D:MG406
|
5.0
|
32.9
|
1.0
|
|
Magnesium binding site 8 out
of 8 in 1cjb
Go back to
Magnesium Binding Sites List in 1cjb
Magnesium binding site 8 out
of 8 in the Malarial Purine Phosphoribosyltransferase
 Mono view
 Stereo pair view
|
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 8 of Malarial Purine Phosphoribosyltransferase within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg406
b:32.9
occ:1.00
|
O
|
D:HOH612
|
2.2
|
34.8
|
1.0
|
|
OD1
|
D:ASP204
|
2.2
|
27.8
|
1.0
|
|
O4
|
D:POP400
|
2.2
|
26.9
|
1.0
|
|
O
|
D:HOH517
|
2.3
|
24.8
|
1.0
|
|
O
|
D:HOH596
|
2.3
|
36.5
|
1.0
|
|
O3
|
D:POP400
|
2.3
|
24.9
|
1.0
|
|
CG
|
D:ASP204
|
3.2
|
27.0
|
1.0
|
|
P1
|
D:POP400
|
3.4
|
29.2
|
1.0
|
|
P2
|
D:POP400
|
3.4
|
28.2
|
1.0
|
|
O
|
D:POP400
|
3.5
|
29.5
|
1.0
|
|
OD2
|
D:ASP204
|
3.6
|
27.5
|
1.0
|
|
N3
|
D:IRP300
|
4.0
|
25.3
|
1.0
|
|
O2
|
D:POP400
|
4.0
|
30.0
|
1.0
|
|
O
|
D:ASP204
|
4.1
|
21.8
|
1.0
|
|
NH2
|
D:ARG210
|
4.2
|
25.7
|
1.0
|
|
O
|
D:HOH621
|
4.3
|
22.9
|
1.0
|
|
O2'
|
D:IRP300
|
4.3
|
24.5
|
1.0
|
|
C1'
|
D:IRP300
|
4.3
|
26.2
|
1.0
|
|
NH1
|
D:ARG210
|
4.4
|
28.3
|
1.0
|
|
N
|
D:ASP204
|
4.4
|
24.8
|
1.0
|
|
O5
|
D:POP400
|
4.4
|
26.5
|
1.0
|
|
O6
|
D:POP400
|
4.4
|
22.9
|
1.0
|
|
CB
|
D:ASP204
|
4.5
|
21.0
|
1.0
|
|
C
|
D:ASP204
|
4.6
|
26.4
|
1.0
|
|
O1
|
D:POP400
|
4.6
|
29.8
|
1.0
|
|
CZ
|
D:ARG210
|
4.7
|
28.9
|
1.0
|
|
CA
|
D:ASP204
|
4.7
|
22.8
|
1.0
|
|
C4
|
D:IRP300
|
4.8
|
25.5
|
1.0
|
|
C2
|
D:IRP300
|
4.8
|
24.3
|
1.0
|
|
CB
|
D:TYR116
|
4.8
|
31.6
|
1.0
|
|
O
|
D:HOH892
|
4.9
|
40.2
|
1.0
|
|
C9
|
D:IRP300
|
4.9
|
24.2
|
1.0
|
|
C2'
|
D:IRP300
|
5.0
|
24.4
|
1.0
|
|
MG
|
D:MG405
|
5.0
|
29.2
|
1.0
|
|
O
|
D:HOH894
|
5.0
|
35.6
|
1.0
|
|
Reference:
W.Shi,
C.M.Li,
P.C.Tyler,
R.H.Furneaux,
S.M.Cahill,
M.E.Girvin,
C.Grubmeyer,
V.L.Schramm,
S.C.Almo.
The 2.0 A Structure of Malarial Purine Phosphoribosyltransferase in Complex with A Transition-State Analogue Inhibitor. Biochemistry V. 38 9872 1999.
ISSN: ISSN 0006-2960
PubMed: 10433693
DOI: 10.1021/BI990664P
Page generated: Mon Dec 14 05:48:48 2020
|
