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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phospho-N-acetylmuramoyl-pentapeptide-transferase' and Ligand = 'BDBM50221499'   
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
Phospho-N-acetylmuramoyl-pentapeptide-transferase


(Escherichia coli (strain K12))		BDBM50221499
PNG
(CHEMBL318555)
Show SMILES [H][C@@]1(O[C@H]([C@H](OCCCCCC)[C@@H]1OC)n1ccc(=O)[nH]c1=O)[C@@H](O[C@H]1OC(=C[C@H](O)[C@@H]1O)C(=O)N[C@H]1CCC[C@@H](C)NC1=O)C(N)=O |c:29|
Show InChI InChI=1S/C30H45N5O12/c1-4-5-6-7-13-44-24-21(43-3)22(46-28(24)35-12-11-19(37)34-30(35)42)23(25(31)39)47-29-20(38)17(36)14-18(45-29)27(41)33-16-10-8-9-15(2)32-26(16)40/h11-12,14-17,20-24,28-29,36,38H,4-10,13H2,1-3H3,(H2,31,39)(H,32,40)(H,33,41)(H,34,37,42)/t15-,16+,17+,20+,21-,22+,23-,24-,28-,29-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 59.9n/an/an/an/an/an/a



Sankyo Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory concentration required against Translocase I

Bioorg Med Chem Lett 13: 2833-6 (2003)


BindingDB Entry DOI: 10.7270/Q2VX0JP8
More data for this
Ligand-Target Pair