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:	Capsule biosynthesis protein
ID:	Q57265_NEIME
AC:	Q57265
Organism:	Neisseria meningitidis
Reign:	Bacteria
TaxID:	487
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:	12.612
Number of residues:	30
Including
Standard Amino Acids:	26
Non Standard Amino Acids:	2
Water Molecules:	2
Cofactors:
Metals:	MN

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Cavity properties

Ligandability	Volume (Å3)
0.753	621.000

% Hydrophobic	% Polar
50.54	49.46
According to VolSite

HET Code:	MMN
Formula:	C8H20NO6
Molecular weight:	226.248 g/mol
DrugBank ID:	DB02787
Buried Surface Area:	61.64 %
Polar Surface area:	137.99 Å2

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

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Mass center Coordinates

X	Y	Z
95.1717	-24.4505	50.5903

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