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:	Cysteine synthase
ID:	CYSK_HAEIN
AC:	P45040
Organism:	Haemophilus influenzae
Reign:	Bacteria
TaxID:	71421
EC Number:	2.5.1.47

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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:	16.956
Number of residues:	35
Including
Standard Amino Acids:	32
Non Standard Amino Acids:	1
Water Molecules:	2
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
0.889	695.250

% Hydrophobic	% Polar
39.32	60.68
According to VolSite

HET Code:	ASN_LEU_ASN_ILE
Formula:	C20H36N6O7
Molecular weight:	472.536 g/mol
DrugBank ID:	-
Buried Surface Area:	53.41 %
Polar Surface area:	241.24 Å2

Number of
H-Bond Acceptors:	7
H-Bond Donors:	6
Rings:	0
Aromatic rings:	0
Anionic atoms:	1
Cationic atoms:	1
Rule of Five Violation:	2
Rotatable Bonds:	15

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Mass center Coordinates

X	Y	Z
19.6021	1.50715	41.5862

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