sc-PDB

List of CHEMBLId :

This value allows a number of roughly comparable measures of half-maximal response concentration/potency/affinity to be compared on a negative logarithmic scale (e.g., an IC50 measurement of 1nM would have a pChEMBL value of 9).

Uniprot Annotation

Name:	Protein kinase 7
ID:	Q7YTF7_PLAF7
AC:	Q7YTF7
Organism:	Plasmodium falciparum
Reign:	Eukaryota
TaxID:	36329
EC Number:	/

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Chains:

Chain Name:	Percentage of Residues within binding site
X	100 %

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Ligand binding site composition:

B-Factor:	32.062
Number of residues:	24
Including
Standard Amino Acids:	24
Non Standard Amino Acids:	0
Water Molecules:	0
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
0.847	732.375

% Hydrophobic	% Polar
49.77	50.23
According to VolSite

HET Code:	HMD
Formula:	C11H11BrN5O2
Molecular weight:	325.141 g/mol
DrugBank ID:	DB02950
Buried Surface Area:	67.24 %
Polar Surface area:	110.88 Å2

Number of
H-Bond Acceptors:	4
H-Bond Donors:	3
Rings:	3
Aromatic rings:	0
Anionic atoms:	0
Cationic atoms:	1
Rule of Five Violation:	0
Rotatable Bonds:	1

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Mass center Coordinates

X	Y	Z
-11.8247	-33.6469	-18.0192

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