Journals
Publish with us
Publishing partnerships
About us
Blog
Journal of Chemistry
Journal overview
For authors
For reviewers
For editors
Table of Contents
Special Issues
Journal of Chemistry
/
2022
/
Article
/
Tab 1
/
Research Article
An
In Silico
Study of the Interactions of Alkaloids from
Cryptolepis sanguinolenta
with
Plasmodium falciparum
Dihydrofolate Reductase and Dihydroorotate Dehydrogenase
Table 1
Protein targets and grid dimensions used in protein-ligand docking.
Protein target
PDB ID
Bound ligand
Grid coordinates and box dimensions
Center (
x
,
y
,
z
) (Å)
Box size (
x
,
y
,
z
) (Å)
wt-
Pf
DHFR
3QGT
Pyrimethamine
26.354, 5.978, 59.033
25, 25, 25
dm-
Pf
DHFR
1J3J
Pyrimethamine
26.229, 6.033, 60.103
30, 30, 30
qm-
Pf
DHFR
1J3K
WR99210
29.093, 6.592, 59.560
18, 18, 18
Pf
DHODH
1TV5
Teriflunomide
38.261, 35.079, 36.636
30, 30, 30