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Compile Data Set for Download or QSAR

Found 4 hits of ki for UniProtKB: Q8Z9U1   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Enoyl-[acyl-carrier-protein] reductase [NADH]


(Yersinia pestis (Enterobacteria))
BDBM50373349
PNG
(CHEMBL264417 | PT12)
Show SMILES CCCCCCc1ccc(Oc2ccc(cc2)[N+]([O-])=O)c(O)c1
Show InChI InChI=1S/C18H21NO4/c1-2-3-4-5-6-14-7-12-18(17(20)13-14)23-16-10-8-15(9-11-16)19(21)22/h7-13,20H,2-6H2,1H3
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
PDB
UniChem

Similars

Article
PubMed
100 -9.54n/an/an/an/an/a8.025



University of Würzburg



Assay Description
Steady-state kinetics were performed on a Cary 100 Bio (Varian) spectrometer at 25 °C using 30 mM PIPES, 150 mM NaCl, and 1.0 mM EDTA (pH 8.0) as...


Biochemistry 55: 2992-3006 (2016)


Article DOI: 10.1021/acs.biochem.5b01301
BindingDB Entry DOI: 10.7270/Q25D8QM3
More data for this
Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH]


(Yersinia pestis (Enterobacteria))
BDBM190659
PNG
(PT156)
Show SMILES CCCCCCc1cc(=O)c(Oc2ccc(cc2)[N+]([O-])=O)cn1C
Show InChI InChI=1S/C18H22N2O4/c1-3-4-5-6-7-15-12-17(21)18(13-19(15)2)24-16-10-8-14(9-11-16)20(22)23/h8-13H,3-7H2,1-2H3
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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Article
PubMed
200 -9.13n/an/an/an/an/a8.025



University of Würzburg



Assay Description
Steady-state kinetics were performed on a Cary 100 Bio (Varian) spectrometer at 25 °C using 30 mM PIPES, 150 mM NaCl, and 1.0 mM EDTA (pH 8.0) as...


Biochemistry 55: 2992-3006 (2016)


Article DOI: 10.1021/acs.biochem.5b01301
BindingDB Entry DOI: 10.7270/Q25D8QM3
More data for this
Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH]


(Yersinia pestis (Enterobacteria))
BDBM190656
PNG
(PT424)
Show SMILES CCCCCCc1ccn(Cc2ccc(cc2)[N+]([O-])=O)c(=O)c1
Show InChI InChI=1S/C18H22N2O3/c1-2-3-4-5-6-15-11-12-19(18(21)13-15)14-16-7-9-17(10-8-16)20(22)23/h7-13H,2-6,14H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
8.00E+3 -6.95n/an/an/an/an/a8.025



University of Würzburg



Assay Description
Steady-state kinetics were performed on a Cary 100 Bio (Varian) spectrometer at 25 °C using 30 mM PIPES, 150 mM NaCl, and 1.0 mM EDTA (pH 8.0) as...


Biochemistry 55: 2992-3006 (2016)


Article DOI: 10.1021/acs.biochem.5b01301
BindingDB Entry DOI: 10.7270/Q25D8QM3
More data for this
Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH]


(Yersinia pestis (Enterobacteria))
BDBM190656
PNG
(PT424)
Show SMILES CCCCCCc1ccn(Cc2ccc(cc2)[N+]([O-])=O)c(=O)c1
Show InChI InChI=1S/C18H22N2O3/c1-2-3-4-5-6-15-11-12-19(18(21)13-15)14-16-7-9-17(10-8-16)20(22)23/h7-13H,2-6,14H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.60E+4 -6.54n/an/an/an/an/a8.025



University of Würzburg



Assay Description
Steady-state kinetics were performed on a Cary 100 Bio (Varian) spectrometer at 25 °C using 30 mM PIPES, 150 mM NaCl, and 1.0 mM EDTA (pH 8.0) as...


Biochemistry 55: 2992-3006 (2016)


Article DOI: 10.1021/acs.biochem.5b01301
BindingDB Entry DOI: 10.7270/Q25D8QM3
More data for this
Ligand-Target Pair