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:	Mitomycin biosynthesis 6-O-methyltransferase
ID:	MMCR_STRLA
AC:	Q9X5T6
Organism:	Streptomyces lavendulae
Reign:	Bacteria
TaxID:	1914
EC Number:	/

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Chains:

Chain Name:	Percentage of Residues within binding site
C	9 %
D	91 %

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Ligand binding site composition:

B-Factor:	35.617
Number of residues:	34
Including
Standard Amino Acids:	32
Non Standard Amino Acids:	1
Water Molecules:	1
Cofactors:
Metals:

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Cavity properties

Ligandability	Volume (Å3)
1.409	941.625

% Hydrophobic	% Polar
54.84	45.16
According to VolSite

HET Code:	MQA
Formula:	C16H20N3O6
Molecular weight:	350.346 g/mol
DrugBank ID:	-
Buried Surface Area:	66.24 %
Polar Surface area:	124.77 Å2

Number of
H-Bond Acceptors:	7
H-Bond Donors:	2
Rings:	4
Aromatic rings:	0
Anionic atoms:	0
Cationic atoms:	1
Rule of Five Violation:	0
Rotatable Bonds:	5

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Mass center Coordinates

X	Y	Z
33.0388	4.41084	48.195

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