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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 = 'BDBM50221202'   
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))		BDBM50221202
PNG
(CHEMBL329032)
Show SMILES [H][C@@]1(O[C@H]([C@H](O)[C@@H]1OC)n1ccc(=O)[nH]c1=O)[C@@H](O[C@H]1OC(=C[C@H](O)[C@@H]1O)C(=O)Nc1ccc(C)cc1C)C(N)=O |c:23|
Show InChI InChI=1S/C25H30N4O11/c1-10-4-5-12(11(2)8-10)27-22(35)14-9-13(30)16(32)24(38-14)40-20(21(26)34)19-18(37-3)17(33)23(39-19)29-7-6-15(31)28-25(29)36/h4-9,13,16-20,23-24,30,32-33H,1-3H3,(H2,26,34)(H,27,35)(H,28,31,36)/t13-,16-,17+,18-,19-,20+,23+,24+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 106n/an/an/an/an/an/a



Sankyo Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against translocase I

Bioorg Med Chem Lett 13: 2829-32 (2003)


BindingDB Entry DOI: 10.7270/Q2TD9WR7
More data for this
Ligand-Target Pair