Binding Site Information of Target

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Target General Information
Drug Binding Sites of Target
References
Target General Information  Top
Target ID T57750 Target Info
Target Name Staphylococcus DHNA-CoA synthase (Stap-coc menB)
Synonyms DHNA-CoA synthase; 1,4-dihydroxy-2-naphthoyl-CoA synthase
Target Type Literature-reported Target
Gene Name Stap-coc menB
Biochemical Class Carbon-carbon lyase
UniProt ID
MENB_STAAC
Drug Binding Sites of Target  Top
Ligand Name: Acetoacetyl-Coenzyme A Ligand Info
Structure Description Crystal structure of Staphylococcus aureus 1,4-dihydroxy-2-naphthoyl CoA synthase (MenB) in complex with acetoacetyl CoA PDB:2UZF
Method X-ray diffraction Resolution 2.90 Å Mutation No [1]
PDB Sequence
WETLREYDEI
15
KYEFYEGIAK
25
VTINRPEVRN
35
AFTPKTVAEM
45
IDAFSRARDD
55

QNVSVIVLTG
65
EGDLAFCSGG
75
DQKGEDQIPR
93
LNVLDLQRLI
103
RIIPKPVIAM
113

VKGYAVGGGN
123
VLNVVCDLTI
133
AADNAIFGQT
143
GPKVGSFDAG
153
YGSGYLARIV
163

GHKKAREIWY
173
LCRQYNAQEA
183
LDMGLVNTVV
193
PLEKVEDETV
203
QWCKEIMKHS
213

PTALRFLKAA
223
MNADTDGLAG
233
LQQMAGDATL
243
LYYTTDEAKE
253
GRDAFKEKRD
263

PDFDQFPKFP
273
Residue
Distance (Å)
GLU32
4.071
VAL33
3.330
ARG34
2.869
ALA36
4.056
PHE37
4.419
SER73
3.347
GLY74
3.710
GLY75
3.057
ASP76
3.238
Residue
Distance (Å)
LYS78
4.587
LEU94
3.743
TYR117
3.125
VAL119
3.876
GLY120
4.381
GLY121
3.663
THR143
3.290
VAL147
3.549
SER149
3.274
References  Top
REF 1 Structure of Staphylococcus aureus1,4-dihydroxy-2-naphthoyl-CoA synthase (MenB) in complex with acetoacetyl-CoA. Acta Crystallogr Sect F Struct Biol Cryst Commun. 2007 Nov 1;63(Pt 11):908-13.

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