Fluorine in PDB 6r8g: Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Enzymatic activity of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
All present enzymatic activity of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine:
1.1.1.37;
Protein crystallography data
The structure of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine, PDB code: 6r8g
was solved by
A.R.Romero,
V.Calderone,
M.Gentili,
S.Lunev,
M.Groves,
G.Popowicz,
A.Domling,
M.Sattler,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
48.97 /
2.00
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
84.760,
106.890,
145.010,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
21 /
23.8
|
Other elements in 6r8g:
The structure of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine also contains other interesting chemical elements:
Fluorine Binding Sites:
The binding sites of Fluorine atom in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
(pdb code 6r8g). This binding sites where shown within
5.0 Angstroms radius around Fluorine atom.
In total 8 binding sites of Fluorine where determined in the
Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine, PDB code: 6r8g:
Jump to Fluorine binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Fluorine binding site 1 out
of 8 in 6r8g
Go back to
Fluorine Binding Sites List in 6r8g
Fluorine binding site 1 out
of 8 in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 1 of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F401
b:58.7
occ:1.00
|
FAM
|
A:JUT401
|
0.0
|
58.7
|
1.0
|
CAL
|
A:JUT401
|
1.2
|
55.8
|
1.0
|
CAJ
|
A:JUT401
|
2.2
|
55.3
|
1.0
|
CAN
|
A:JUT401
|
2.3
|
53.8
|
1.0
|
FAK
|
A:JUT401
|
2.7
|
57.4
|
1.0
|
O
|
C:VAL187
|
3.3
|
30.1
|
1.0
|
CAI
|
A:JUT401
|
3.4
|
54.8
|
1.0
|
CB
|
C:ASN188
|
3.5
|
28.5
|
1.0
|
CAG
|
A:JUT401
|
3.5
|
55.0
|
1.0
|
CG2
|
C:VAL190
|
3.6
|
31.9
|
1.0
|
O
|
C:ASN188
|
3.6
|
28.2
|
1.0
|
ND2
|
C:ASN188
|
3.7
|
31.7
|
1.0
|
CAH
|
A:JUT401
|
3.9
|
54.9
|
1.0
|
CG2
|
A:VAL169
|
4.0
|
31.0
|
1.0
|
CG
|
C:ASN188
|
4.1
|
29.5
|
1.0
|
C
|
C:ASN188
|
4.2
|
28.2
|
1.0
|
CE2
|
A:PHE284
|
4.2
|
37.7
|
1.0
|
C
|
C:VAL187
|
4.2
|
29.1
|
1.0
|
CA
|
C:ASN188
|
4.2
|
27.7
|
1.0
|
CB
|
C:VAL190
|
4.4
|
32.9
|
1.0
|
CD1
|
A:LEU250
|
4.5
|
37.9
|
1.0
|
CB
|
A:LEU250
|
4.6
|
36.7
|
1.0
|
N
|
C:ASN188
|
4.6
|
27.5
|
1.0
|
CZ
|
A:PHE284
|
4.6
|
36.4
|
1.0
|
CAD
|
A:JUT401
|
4.7
|
57.2
|
1.0
|
CG2
|
A:THR271
|
4.8
|
29.4
|
1.0
|
N
|
C:VAL190
|
5.0
|
30.8
|
1.0
|
|
Fluorine binding site 2 out
of 8 in 6r8g
Go back to
Fluorine Binding Sites List in 6r8g
Fluorine binding site 2 out
of 8 in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 2 of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:F401
b:57.4
occ:1.00
|
FAK
|
A:JUT401
|
0.0
|
57.4
|
1.0
|
CAJ
|
A:JUT401
|
1.4
|
55.3
|
1.0
|
CAI
|
A:JUT401
|
2.3
|
54.8
|
1.0
|
CAL
|
A:JUT401
|
2.5
|
55.8
|
1.0
|
FAM
|
A:JUT401
|
2.7
|
58.7
|
1.0
|
ND2
|
C:ASN188
|
3.3
|
31.7
|
1.0
|
CG2
|
A:THR271
|
3.4
|
29.4
|
1.0
|
CAH
|
A:JUT401
|
3.6
|
54.9
|
1.0
|
O
|
A:PHE251
|
3.6
|
31.7
|
1.0
|
CAN
|
A:JUT401
|
3.8
|
53.8
|
1.0
|
CB
|
A:THR271
|
3.8
|
30.1
|
1.0
|
C
|
A:PHE251
|
3.9
|
31.1
|
1.0
|
CA
|
A:THR271
|
4.0
|
29.4
|
1.0
|
N
|
A:PHE251
|
4.1
|
34.1
|
1.0
|
CG2
|
A:THR252
|
4.1
|
34.8
|
1.0
|
CAG
|
A:JUT401
|
4.2
|
55.0
|
1.0
|
CG2
|
A:VAL169
|
4.2
|
31.0
|
1.0
|
N
|
A:THR252
|
4.4
|
30.6
|
1.0
|
CB
|
A:LEU250
|
4.4
|
36.7
|
1.0
|
CG
|
C:ASN188
|
4.5
|
29.5
|
1.0
|
N
|
A:ALA272
|
4.5
|
29.8
|
1.0
|
CA
|
A:PHE251
|
4.5
|
35.6
|
1.0
|
C
|
A:LEU250
|
4.5
|
37.5
|
1.0
|
O
|
A:ALA272
|
4.7
|
26.5
|
1.0
|
CB
|
C:ASN188
|
4.7
|
28.5
|
1.0
|
C
|
A:THR271
|
4.8
|
30.2
|
1.0
|
CA
|
A:LEU250
|
4.9
|
36.1
|
1.0
|
|
Fluorine binding site 3 out
of 8 in 6r8g
Go back to
Fluorine Binding Sites List in 6r8g
Fluorine binding site 3 out
of 8 in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 3 of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:F402
b:53.4
occ:1.00
|
FAM
|
C:JUT402
|
0.0
|
53.4
|
1.0
|
CAL
|
C:JUT402
|
1.3
|
56.3
|
1.0
|
CAJ
|
C:JUT402
|
2.3
|
54.5
|
1.0
|
CAN
|
C:JUT402
|
2.4
|
53.8
|
1.0
|
FAK
|
C:JUT402
|
2.7
|
57.5
|
1.0
|
ND2
|
A:ASN188
|
3.3
|
29.3
|
1.0
|
CAI
|
C:JUT402
|
3.5
|
53.4
|
1.0
|
CG2
|
C:VAL169
|
3.5
|
32.1
|
1.0
|
O
|
A:ASN188
|
3.5
|
28.3
|
1.0
|
CB
|
A:ASN188
|
3.5
|
28.6
|
1.0
|
CAG
|
C:JUT402
|
3.6
|
55.6
|
1.0
|
CG2
|
A:VAL190
|
3.7
|
34.8
|
1.0
|
O
|
A:VAL187
|
3.8
|
27.3
|
1.0
|
CG
|
A:ASN188
|
3.9
|
29.5
|
1.0
|
CD2
|
C:LEU250
|
4.0
|
34.7
|
1.0
|
CAH
|
C:JUT402
|
4.0
|
54.4
|
1.0
|
CE2
|
C:PHE284
|
4.2
|
37.5
|
1.0
|
C
|
A:ASN188
|
4.2
|
28.9
|
1.0
|
CG2
|
C:THR271
|
4.3
|
34.5
|
1.0
|
CA
|
A:ASN188
|
4.4
|
28.2
|
1.0
|
C
|
A:VAL187
|
4.7
|
27.0
|
1.0
|
CB
|
A:VAL190
|
4.8
|
33.5
|
1.0
|
CB
|
C:LEU250
|
4.8
|
32.5
|
1.0
|
CZ
|
C:PHE284
|
4.8
|
36.8
|
1.0
|
CG
|
C:LEU250
|
4.8
|
36.7
|
1.0
|
CAD
|
C:JUT402
|
4.8
|
61.1
|
1.0
|
CB
|
C:VAL169
|
4.9
|
32.3
|
1.0
|
CB
|
C:THR271
|
4.9
|
32.5
|
1.0
|
N
|
A:ASN188
|
4.9
|
26.4
|
1.0
|
CD2
|
C:PHE284
|
5.0
|
37.4
|
1.0
|
|
Fluorine binding site 4 out
of 8 in 6r8g
Go back to
Fluorine Binding Sites List in 6r8g
Fluorine binding site 4 out
of 8 in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 4 of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:F402
b:57.5
occ:1.00
|
FAK
|
C:JUT402
|
0.0
|
57.5
|
1.0
|
CAJ
|
C:JUT402
|
1.3
|
54.5
|
1.0
|
CAI
|
C:JUT402
|
2.2
|
53.4
|
1.0
|
CAL
|
C:JUT402
|
2.4
|
56.3
|
1.0
|
FAM
|
C:JUT402
|
2.7
|
53.4
|
1.0
|
O
|
C:PHE251
|
3.3
|
28.0
|
1.0
|
ND2
|
A:ASN188
|
3.4
|
29.3
|
1.0
|
CAH
|
C:JUT402
|
3.5
|
54.4
|
1.0
|
CG2
|
C:THR271
|
3.5
|
34.5
|
1.0
|
CB
|
C:THR271
|
3.7
|
32.5
|
1.0
|
CAN
|
C:JUT402
|
3.7
|
53.8
|
1.0
|
CA
|
C:THR271
|
3.8
|
29.8
|
1.0
|
C
|
C:PHE251
|
3.8
|
28.8
|
1.0
|
N
|
C:PHE251
|
3.9
|
29.6
|
1.0
|
CAG
|
C:JUT402
|
4.1
|
55.6
|
1.0
|
N
|
C:ALA272
|
4.1
|
29.6
|
1.0
|
CG2
|
C:THR252
|
4.2
|
33.4
|
1.0
|
CB
|
C:LEU250
|
4.3
|
32.5
|
1.0
|
O
|
C:ALA272
|
4.3
|
28.9
|
1.0
|
C
|
C:LEU250
|
4.3
|
29.9
|
1.0
|
CA
|
C:PHE251
|
4.3
|
30.0
|
1.0
|
N
|
C:THR252
|
4.4
|
27.0
|
1.0
|
C
|
C:THR271
|
4.4
|
29.5
|
1.0
|
CG
|
A:ASN188
|
4.6
|
29.5
|
1.0
|
CG2
|
C:VAL169
|
4.6
|
32.1
|
1.0
|
CA
|
C:LEU250
|
4.7
|
29.1
|
1.0
|
CG
|
C:LEU250
|
4.8
|
36.7
|
1.0
|
CD2
|
C:LEU250
|
4.8
|
34.7
|
1.0
|
CB
|
A:ASN188
|
4.9
|
28.6
|
1.0
|
O
|
C:LEU250
|
5.0
|
31.7
|
1.0
|
N
|
C:THR271
|
5.0
|
27.4
|
1.0
|
|
Fluorine binding site 5 out
of 8 in 6r8g
Go back to
Fluorine Binding Sites List in 6r8g
Fluorine binding site 5 out
of 8 in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 5 of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:F401
b:47.3
occ:1.00
|
FAM
|
D:JUT401
|
0.0
|
47.3
|
1.0
|
CAL
|
D:JUT401
|
1.4
|
42.0
|
1.0
|
CAJ
|
D:JUT401
|
2.3
|
42.1
|
1.0
|
CAN
|
D:JUT401
|
2.6
|
39.5
|
1.0
|
FAK
|
D:JUT401
|
2.7
|
42.1
|
1.0
|
O
|
D:ASN188
|
3.2
|
28.9
|
1.0
|
ND2
|
D:ASN188
|
3.3
|
32.1
|
1.0
|
CG2
|
B:VAL169
|
3.4
|
26.9
|
1.0
|
CB
|
D:ASN188
|
3.4
|
28.0
|
1.0
|
CG2
|
D:VAL190
|
3.5
|
28.2
|
1.0
|
O
|
D:VAL187
|
3.5
|
22.8
|
1.0
|
CAI
|
D:JUT401
|
3.6
|
43.3
|
1.0
|
CAG
|
D:JUT401
|
3.8
|
43.0
|
1.0
|
CG
|
D:ASN188
|
3.8
|
30.1
|
1.0
|
C
|
D:ASN188
|
4.0
|
26.5
|
1.0
|
CAH
|
D:JUT401
|
4.1
|
42.4
|
1.0
|
CA
|
D:ASN188
|
4.2
|
26.0
|
1.0
|
C
|
D:VAL187
|
4.4
|
23.2
|
1.0
|
CE2
|
B:PHE284
|
4.4
|
30.9
|
1.0
|
CB
|
D:VAL190
|
4.5
|
27.1
|
1.0
|
CG2
|
B:THR271
|
4.6
|
26.2
|
1.0
|
N
|
D:ASN188
|
4.7
|
24.4
|
1.0
|
CB
|
B:VAL169
|
4.8
|
27.2
|
1.0
|
N
|
D:VAL190
|
4.9
|
23.8
|
1.0
|
CB
|
B:LEU250
|
4.9
|
31.2
|
1.0
|
OD1
|
D:ASN188
|
5.0
|
30.0
|
1.0
|
CZ
|
B:PHE284
|
5.0
|
29.0
|
1.0
|
|
Fluorine binding site 6 out
of 8 in 6r8g
Go back to
Fluorine Binding Sites List in 6r8g
Fluorine binding site 6 out
of 8 in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 6 of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:F401
b:42.1
occ:1.00
|
FAK
|
D:JUT401
|
0.0
|
42.1
|
1.0
|
CAJ
|
D:JUT401
|
1.3
|
42.1
|
1.0
|
CAI
|
D:JUT401
|
2.2
|
43.3
|
1.0
|
CAL
|
D:JUT401
|
2.4
|
42.0
|
1.0
|
FAM
|
D:JUT401
|
2.7
|
47.3
|
1.0
|
ND2
|
D:ASN188
|
3.2
|
32.1
|
1.0
|
O
|
B:PHE251
|
3.4
|
27.9
|
1.0
|
CAH
|
D:JUT401
|
3.5
|
42.4
|
1.0
|
CG2
|
B:THR271
|
3.5
|
26.2
|
1.0
|
CAN
|
D:JUT401
|
3.7
|
39.5
|
1.0
|
C
|
B:PHE251
|
3.7
|
25.9
|
1.0
|
N
|
B:PHE251
|
3.9
|
29.2
|
1.0
|
CB
|
B:THR271
|
3.9
|
26.9
|
1.0
|
CAG
|
D:JUT401
|
4.0
|
43.0
|
1.0
|
CA
|
B:THR271
|
4.1
|
26.6
|
1.0
|
CG2
|
B:THR252
|
4.2
|
27.5
|
1.0
|
CA
|
B:PHE251
|
4.3
|
28.0
|
1.0
|
N
|
B:THR252
|
4.3
|
26.1
|
1.0
|
C
|
B:LEU250
|
4.3
|
31.5
|
1.0
|
CB
|
B:LEU250
|
4.3
|
31.2
|
1.0
|
CG2
|
B:VAL169
|
4.4
|
26.9
|
1.0
|
CG
|
D:ASN188
|
4.4
|
30.1
|
1.0
|
N
|
B:ALA272
|
4.5
|
26.1
|
1.0
|
O
|
B:ALA272
|
4.6
|
25.7
|
1.0
|
CB
|
D:ASN188
|
4.7
|
28.0
|
1.0
|
CA
|
B:LEU250
|
4.8
|
31.5
|
1.0
|
C
|
B:THR271
|
4.8
|
26.6
|
1.0
|
O
|
B:LEU250
|
4.9
|
31.4
|
1.0
|
|
Fluorine binding site 7 out
of 8 in 6r8g
Go back to
Fluorine Binding Sites List in 6r8g
Fluorine binding site 7 out
of 8 in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 7 of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:F402
b:38.9
occ:1.00
|
FAM
|
D:JUT402
|
0.0
|
38.9
|
1.0
|
CAL
|
D:JUT402
|
1.4
|
38.8
|
1.0
|
CAJ
|
D:JUT402
|
2.2
|
38.4
|
1.0
|
FAK
|
D:JUT402
|
2.4
|
45.8
|
1.0
|
CAN
|
D:JUT402
|
2.7
|
38.3
|
1.0
|
ND2
|
B:ASN188
|
3.0
|
25.9
|
1.0
|
O
|
B:ASN188
|
3.2
|
26.3
|
1.0
|
CB
|
B:ASN188
|
3.3
|
24.6
|
1.0
|
CG2
|
D:VAL169
|
3.4
|
25.2
|
1.0
|
CAI
|
D:JUT402
|
3.4
|
39.8
|
1.0
|
O
|
B:VAL187
|
3.6
|
22.1
|
1.0
|
CG2
|
B:VAL190
|
3.7
|
31.8
|
1.0
|
CG
|
B:ASN188
|
3.7
|
26.0
|
1.0
|
CAG
|
D:JUT402
|
3.9
|
38.2
|
1.0
|
C
|
B:ASN188
|
4.0
|
25.7
|
1.0
|
CAH
|
D:JUT402
|
4.0
|
39.3
|
1.0
|
CA
|
B:ASN188
|
4.2
|
24.7
|
1.0
|
CG2
|
D:THR271
|
4.4
|
29.8
|
1.0
|
C
|
B:VAL187
|
4.5
|
22.6
|
1.0
|
CE2
|
D:PHE284
|
4.6
|
31.5
|
1.0
|
CB
|
B:VAL190
|
4.7
|
29.4
|
1.0
|
N
|
B:ASN188
|
4.8
|
23.3
|
1.0
|
OD1
|
B:ASN188
|
4.8
|
23.4
|
1.0
|
CB
|
D:VAL169
|
4.8
|
25.0
|
1.0
|
CB
|
D:LEU250
|
4.9
|
27.6
|
1.0
|
CD1
|
D:LEU250
|
4.9
|
32.9
|
1.0
|
N
|
B:VAL190
|
5.0
|
27.0
|
1.0
|
|
Fluorine binding site 8 out
of 8 in 6r8g
Go back to
Fluorine Binding Sites List in 6r8g
Fluorine binding site 8 out
of 8 in the Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine
Mono view
Stereo pair view
|
A full contact list of Fluorine with other atoms in the F binding
site number 8 of Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with 4-(3,4-Difluorophenyl)Thiazol-2-Amine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:F402
b:45.8
occ:1.00
|
FAK
|
D:JUT402
|
0.0
|
45.8
|
1.0
|
CAJ
|
D:JUT402
|
1.3
|
38.4
|
1.0
|
CAI
|
D:JUT402
|
2.2
|
39.8
|
1.0
|
CAL
|
D:JUT402
|
2.4
|
38.8
|
1.0
|
FAM
|
D:JUT402
|
2.4
|
38.9
|
1.0
|
ND2
|
B:ASN188
|
3.0
|
25.9
|
1.0
|
CAH
|
D:JUT402
|
3.5
|
39.3
|
1.0
|
CG2
|
D:THR271
|
3.6
|
29.8
|
1.0
|
O
|
D:PHE251
|
3.7
|
28.7
|
1.0
|
CAN
|
D:JUT402
|
3.8
|
38.3
|
1.0
|
CB
|
D:THR271
|
3.9
|
28.7
|
1.0
|
CA
|
D:THR271
|
4.0
|
28.0
|
1.0
|
C
|
D:PHE251
|
4.1
|
27.8
|
1.0
|
N
|
D:PHE251
|
4.2
|
25.6
|
1.0
|
CAG
|
D:JUT402
|
4.2
|
38.2
|
1.0
|
CG
|
B:ASN188
|
4.2
|
26.0
|
1.0
|
CG2
|
D:THR252
|
4.2
|
31.6
|
1.0
|
CG2
|
D:VAL169
|
4.3
|
25.2
|
1.0
|
CB
|
D:LEU250
|
4.3
|
27.6
|
1.0
|
N
|
D:ALA272
|
4.4
|
26.3
|
1.0
|
CB
|
B:ASN188
|
4.5
|
24.6
|
1.0
|
C
|
D:LEU250
|
4.6
|
26.3
|
1.0
|
N
|
D:THR252
|
4.6
|
28.5
|
1.0
|
CA
|
D:PHE251
|
4.6
|
26.2
|
1.0
|
O
|
D:ALA272
|
4.6
|
24.2
|
1.0
|
C
|
D:THR271
|
4.7
|
28.4
|
1.0
|
CA
|
D:LEU250
|
4.9
|
26.3
|
1.0
|
O
|
B:ASN188
|
5.0
|
26.3
|
1.0
|
|
Reference:
A.R.Romero,
V.Calderone,
S.Lunev,
M.Groves,
G.Popowicz,
A.Domling,
M.Sattler.
Crystal Structure of Malate Dehydrogenase From Plasmodium Falciparum in Complex with Small Molecule at 2.0 Angstroms Resolution To Be Published.
Page generated: Fri Aug 2 01:08:01 2024
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