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:	C-1-tetrahydrofolate synthase, cytoplasmic
ID:	C1TC_HUMAN
AC:	P11586
Organism:	Homo sapiens
Reign:	Eukaryota
TaxID:	9606
EC Number:	1.5.1.5

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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:	28.998
Number of residues:	29
Including
Standard Amino Acids:	25
Non Standard Amino Acids:	1
Water Molecules:	3
Cofactors:	NAP
Metals:

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Cavity properties

Ligandability	Volume (Å3)
0.821	769.500

% Hydrophobic	% Polar
45.61	54.39
According to VolSite

HET Code:	L37
Formula:	C17H17N7O7
Molecular weight:	431.360 g/mol
DrugBank ID:	DB02358
Buried Surface Area:	44.37 %
Polar Surface area:	248.53 Å2

Number of
H-Bond Acceptors:	11
H-Bond Donors:	6
Rings:	2
Aromatic rings:	2
Anionic atoms:	2
Cationic atoms:	0
Rule of Five Violation:	2
Rotatable Bonds:	8

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Mass center Coordinates

X	Y	Z
0.473839	57.4302	20.6871

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