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:	Inosine-5'-monophosphate dehydrogenase 2
ID:	IMDH2_HUMAN
AC:	P12268
Organism:	Homo sapiens
Reign:	Eukaryota
TaxID:	9606
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:	47.552
Number of residues:	35
Including
Standard Amino Acids:	34
Non Standard Amino Acids:	0
Water Molecules:	1
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
0.810	857.250

% Hydrophobic	% Polar
31.89	68.11
According to VolSite

HET Code:	RVP
Formula:	C8H11N4O8P
Molecular weight:	322.169 g/mol
DrugBank ID:	-
Buried Surface Area:	72.67 %
Polar Surface area:	205.72 Å2

Number of
H-Bond Acceptors:	10
H-Bond Donors:	3
Rings:	2
Aromatic rings:	1
Anionic atoms:	2
Cationic atoms:	0
Rule of Five Violation:	1
Rotatable Bonds:	5

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Mass center Coordinates

X	Y	Z
62.9071	50.8989	-5.32633

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