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BDBM81331 MeGTP (6b)

SMILES: COc1nc2c(nc(N)[nH]c2=O)n1[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OP(O)([O-])=O)C(O)C1O

InChI Key: InChIKey=ASABXRLJRLSUPF-VKJDSPIKSA-K

Data: 2 IC50  1 Kd

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 81331   
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
FtsZ


(Aquifex aeolicus)
BDBM81331
PNG
(MeGTP (6b))
Show SMILES COc1nc2c(nc(N)[nH]c2=O)n1[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OP(O)([O-])=O)C(O)C1O |r|
Show InChI InChI=1S/C11H18N5O15P3/c1-27-11-13-4-7(14-10(12)15-8(4)19)16(11)9-6(18)5(17)3(29-9)2-28-33(23,24)31-34(25,26)30-32(20,21)22/h3,5-6,9,17-18H,2H2,1H3,(H,23,24)(H,25,26)(H2,20,21,22)(H3,12,14,15,19)/p-3/t3-,5?,6?,9-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.53E+4n/an/an/an/a7.5n/a



University of Amsterdam



Assay Description
The binding affinities to FtsZ were determined by a fluorescent coupled assay for phosphate relase. In this GTPase studies, phosphate liberated durin...


Chem Biol 15: 189-99 (2008)


Article DOI: 10.1016/j.chembiol.2007.12.013
BindingDB Entry DOI: 10.7270/Q2P849CR
More data for this
Ligand-Target Pair
FtsZ


(Aquifex aeolicus)
BDBM81331
PNG
(MeGTP (6b))
Show SMILES COc1nc2c(nc(N)[nH]c2=O)n1[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OP(O)([O-])=O)C(O)C1O |r|
Show InChI InChI=1S/C11H18N5O15P3/c1-27-11-13-4-7(14-10(12)15-8(4)19)16(11)9-6(18)5(17)3(29-9)2-28-33(23,24)31-34(25,26)30-32(20,21)22/h3,5-6,9,17-18H,2H2,1H3,(H,23,24)(H,25,26)(H2,20,21,22)(H3,12,14,15,19)/p-3/t3-,5?,6?,9-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+4 3.33n/an/an/a7.5n/a



University of Amsterdam



Assay Description
The binding affinities to FtsZ were determined by a fluorescent competition assay with 2'/3'-O-(N-methyl-anthraniloyl)-guanosine-5'-triph...


Chem Biol 15: 189-99 (2008)


Article DOI: 10.1016/j.chembiol.2007.12.013
BindingDB Entry DOI: 10.7270/Q2P849CR
More data for this
Ligand-Target Pair