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:	Mevalonate kinase
ID:	Q4Q6K7_LEIMA
AC:	Q4Q6K7
Organism:	Leishmania major
Reign:	Eukaryota
TaxID:	5664
EC Number:	/

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Chains:

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

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Ligand binding site composition:

B-Factor:	22.786
Number of residues:	22
Including
Standard Amino Acids:	20
Non Standard Amino Acids:	0
Water Molecules:	2
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
0.837	894.375

% Hydrophobic	% Polar
32.83	67.17
According to VolSite

HET Code:	MEV
Formula:	C6H11O4
Molecular weight:	147.149 g/mol
DrugBank ID:	DB03518
Buried Surface Area:	66.5 %
Polar Surface area:	80.59 Å2

Number of
H-Bond Acceptors:	4
H-Bond Donors:	2
Rings:	0
Aromatic rings:	0
Anionic atoms:	1
Cationic atoms:	0
Rule of Five Violation:	0
Rotatable Bonds:	4

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Mass center Coordinates

X	Y	Z
13.8432	-8.2835	13.9299

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