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:	Histone-arginine methyltransferase CARM1
ID:	CARM1_HUMAN
AC:	Q86X55
Organism:	Homo sapiens
Reign:	Eukaryota
TaxID:	9606
EC Number:	/

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Chains:

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

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Ligand binding site composition:

B-Factor:	24.753
Number of residues:	33
Including
Standard Amino Acids:	29
Non Standard Amino Acids:	2
Water Molecules:	2
Cofactors:
Metals:	CL

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Cavity properties

Ligandability	Volume (Å3)
0.717	729.000

% Hydrophobic	% Polar
43.52	56.48
According to VolSite

HET Code:	845
Formula:	C24H23F3N7O2
Molecular weight:	498.480 g/mol
DrugBank ID:	-
Buried Surface Area:	62.47 %
Polar Surface area:	121.42 Å2

Number of
H-Bond Acceptors:	6
H-Bond Donors:	5
Rings:	5
Aromatic rings:	3
Anionic atoms:	0
Cationic atoms:	1
Rule of Five Violation:	0
Rotatable Bonds:	6

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Mass center Coordinates

X	Y	Z
29.5543	-19.2566	-22.5447

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