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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA gyrase subunit A' and Ligand = 'BDBM139397'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
DNA gyrase subunit A


(Escherichia coli (strain K12))		BDBM139397
PNG
(US8889671, 26)
Show SMILES C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@@H](CO)OC2=O)C(=O)NC(=O)NC1=O |r|
Show InChI InChI=1S/C22H22FN5O8/c1-8-5-27-14-10(4-22(16(27)9(2)34-8)18(30)24-20(32)25-19(22)31)3-12-15(13(14)23)36-26-17(12)28-6-11(7-29)35-21(28)33/h3,8-9,11,16,29H,4-7H2,1-2H3,(H2,24,25,30,31,32)/t8-,9+,11+,16-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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Similars
US Patent
n/an/a 170n/an/an/an/a7.5n/a



AstraZeneca AB

US Patent


Assay Description
In a black, 384-well polystyrene assay plate, 30 microliters/well of 5 nM Escherichia coli DNA gyrase A/B tetramer and 130 micrograms/mL of topologic...

US Patent US8889671 (2014)


BindingDB Entry DOI: 10.7270/Q22J69JX
More data for this
Ligand-Target Pair